Vitas-M small molecule compound

2-[(N-benzylglycyl)amino]-6-tert-butyl-N-(2,4-dimethylphenyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Catalog ID
STK385241
SMILES O=C(Nc1sc2c(c1C(=O)Nc1ccc(cc1C)C)CCC(C2)C(C)(C)C)CNCc1ccccc1

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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 C30H37N3O2S MW 503.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H37N3O2S/c1-19-11-14-24(20(2)15-19)32-28(35)27-23-13-12-22(30(3,4)5)16-25(23)36-29(27)33-26(34)18-31-17-21-9-7-6-8-10-21/h6-11,14-15,22,31H,12-13,16-18H2,1-5H3,(H,32,35)(H,33,34)
InChIKey
KTRMCPBIXAXWMC-UHFFFAOYSA-N
Synonyms

2((2(benzylamino)acetyl)amino)6tertbutylN(24dimethylphenyl)4567tetrahydro1benzothiophene3carboxamide
2((Nbenzylglycyl)amino)6tertbutylN(24dimethylphenyl)4567tetrahydro1benzothiophene3carboxamide
CC1=CC(=C(C=C1)NC(=O)C2=C(SC3=C2CCC(C3)C(C)(C)C)NC(=O)CNCC4=CC=CC=C4)C
InChI=1SC30H37N3O2Sc119111424(20(2)1519)3228(35)2723131222(30(34)5)1625(23)3629(27)3326(34)1831172197681021h61114152231H12131618H215H3(H3235)(H3334)
MFCD03274079
ZINC000015946557
ZINC000015946559

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Available files

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