COMPOUND: C12767
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Entry
C12767 Compound
Name
Dibenzthion;
Sulbentine
Formula
C17H18N2S2
Exact mass
314.0911
Mol weight
314.4682
Structure
Mol file
KCF file
DB search
Remark
Same as:
D01335
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:
br08303
]
D DERMATOLOGICALS
D01 ANTIFUNGALS FOR DERMATOLOGICAL USE
D01A ANTIFUNGALS FOR TOPICAL USE
D01AE Other antifungals for topical use
D01AE09 Sulbentine
D01335 Dibenzthion (JAN)
BRITE hierarchy
Other DBs
CAS:
350-12-9
PubChem:
583156
ChEBI:
31477
NIKKAJI:
J5.690A
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KCF data
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ATOM 21
1 C2y C 25.0763 -17.4361
2 N1y N 25.0763 -16.0356
3 C1x C 26.2921 -15.3354
4 N1y N 27.5008 -16.0356
5 C1x C 27.5008 -17.4361
6 S2x S 26.2921 -18.1363
7 C1b C 28.7140 -15.3362
8 C8y C 29.9264 -16.0373
9 C1b C 23.8638 -15.3347
10 C8y C 22.6505 -16.0343
11 S0 S 23.8638 -18.1368
12 C8x C 31.1320 -15.3361
13 C8x C 32.3444 -16.0373
14 C8x C 32.3432 -17.4378
15 C8x C 31.1299 -18.1370
16 C8x C 29.9876 -17.4359
17 C8x C 22.6502 -17.4334
18 C8x C 21.4371 -18.1329
19 C8x C 20.2246 -17.4322
20 C8x C 20.2253 -16.0317
21 C8x C 21.4385 -15.3320
BOND 23
1 4 5 1
2 1 11 2
3 5 6 1
4 6 1 1
5 4 7 1
6 1 2 1
7 8 12 2
8 12 13 1
9 13 14 2
10 14 15 1
11 15 16 2
12 16 8 1
13 7 8 1
14 2 3 1
15 2 9 1
16 3 4 1
17 9 10 1
18 10 17 2
19 17 18 1
20 18 19 2
21 19 20 1
22 20 21 2
23 21 10 1
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