Vitas-M small molecule compound
11-[4-(dimethylamino)phenyl]-N-(4-fluorophenyl)-3,3-dimethyl-1-oxo-1,2,3,4,5,11-hexahydro-10H-dibenzo[b,e][1,4]diazepine-10-carbothioamide
Catalog ID
STL444586
SMILES Fc1ccc(cc1)NC(=S)N1c2ccccc2NC2=C(C1c1ccc(cc1)N(C)C)C(=O)CC(C2)(C)C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C30H31FN4OS MW 514.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H31FN4OS/c1-30(2)17-24-27(26(36)18-30)28(19-9-15-22(16-10-19)34(3)4)35(25-8-6-5-7-23(25)33-24)29(37)32-21-13-11-20(31)12-14-21/h5-16,28,33H,17-18H2,1-4H3,(H,32,37)InChIKey
ZSXYUKJFAOIZMK-UHFFFAOYSA-NSynonyms
11(4(dimethylamino)phenyl)N(4fluorophenyl)33dimethyl1oxo1234511hexahydro10Hdibenzo(be)(14)diazepine10carbothioamide
6(4(dimethylamino)phenyl)N(4fluorophenyl)99dimethyl7oxo681011tetrahydrobenzo(b)(14)benzodiazepine5carbothioamide
CC1(CC2=C(C(N(C3=CC=CC=C3N2)C(=S)NC4=CC=C(C=C4)F)C5=CC=C(C=C5)N(C)C)C(=O)C1)C
InChI=1SC30H31FN4OSc130(2)172427(26(36)1830)28(1991522(161019)34(3)4)35(25865723(25)3324)29(37)3221131120(31)121421h5162833H1718H214H3(H3237)
MFCD01942653
ZINC000008694799
ZINC000008694800
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