Vitas-M small molecule compound

11-(4-tert-butylphenyl)-1-hydroxy-3,3-dimethyl-N-phenyl-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepine-10-carbothioamide

Catalog ID
STL041682
SMILES OC1=C2C(=Nc3c(N(C2c2ccc(cc2)C(C)(C)C)C(=S)Nc2ccccc2)cccc3)CC(C1)(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 C32H35N3OS MW 509.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H35N3OS/c1-31(2,3)22-17-15-21(16-18-22)29-28-25(19-32(4,5)20-27(28)36)34-24-13-9-10-14-26(24)35(29)30(37)33-23-11-7-6-8-12-23/h6-18,29,36H,19-20H2,1-5H3,(H,33,37)
InChIKey
USIDMJVHJIEJPA-UHFFFAOYSA-N
Synonyms

11(4tertbutylphenyl)1hydroxy33dimethylNphenyl23411tetrahydro10Hdibenzo(be)(14)diazepine10carbothioamide
MFCD05729344
ZINC000102868778
ZINC000102868781

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.