Vitas-M small molecule compound
11-{4-[(4-chlorobenzyl)oxy]-3-ethoxyphenyl}-N-ethyl-3,3-dimethyl-1-oxo-1,2,3,4,5,11-hexahydro-10H-dibenzo[b,e][1,4]diazepine-10-carbothioamide
Catalog ID
STK149718
SMILES CCNC(=S)N1C(c2ccc(c(c2)OCC)OCc2ccc(cc2)Cl)C2=C(Nc3c1cccc3)CC(CC2=O)(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 C33H36ClN3O3S MW 590.19 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H36ClN3O3S/c1-5-35-32(41)37-26-10-8-7-9-24(26)36-25-18-33(3,4)19-27(38)30(25)31(37)22-13-16-28(29(17-22)39-6-2)40-20-21-11-14-23(34)15-12-21/h7-17,31,36H,5-6,18-20H2,1-4H3,(H,35,41)InChIKey
MWGLRRBODNUVTG-UHFFFAOYSA-NSynonyms
11(4((4chlorobenzyl)oxy)3ethoxyphenyl)Nethyl33dimethyl1oxo1234511hexahydro10Hdibenzo(be)(14)diazepine10carbothioamide
11(4((4chlorobenzyl)oxy)3ethoxyphenyl)Nethyl33dimethyl1oxo34511tetrahydro1Hdibenzo(be)(14)diazepine10(2H)carbothioamide
6(4((4chlorophenyl)methoxy)3ethoxyphenyl)Nethyl99dimethyl7oxo681011tetrahydrobenzo(b)(14)benzodiazepine5carbothioamide
CCNC(=S)N1C(C2=C(CC(CC2=O)(C)C)NC3=CC=CC=C31)C4=CC(=C(C=C4)OCC5=CC=C(C=C5)Cl)OCC
InChI=1SC33H36ClN3O3Sc153532(41)37261087924(26)36251833(34)1927(38)30(25)31(37)22131628(29(1722)3962)402021111423(34)151221h7173136H561820H214H3(H3541)
MFCD03613038
ZINC000053339406
ZINC000053339409
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