Vitas-M small molecule compound

5-cyano-6-({2-[(4-ethylphenyl)amino]-2-oxoethyl}sulfanyl)-2-methyl-N-(2-methylphenyl)-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxamide

Catalog ID
STK536334
SMILES N#CC1=C(SCC(=O)Nc2ccc(cc2)CC)NC(=C(C1c1cccs1)C(=O)Nc1ccccc1C)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 C29H28N4O2S2 MW 528.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H28N4O2S2/c1-4-20-11-13-21(14-12-20)32-25(34)17-37-29-22(16-30)27(24-10-7-15-36-24)26(19(3)31-29)28(35)33-23-9-6-5-8-18(23)2/h5-15,27,31H,4,17H2,1-3H3,(H,32,34)(H,33,35)
InChIKey
CNOJBZYHOYFDTF-UHFFFAOYSA-N
Synonyms

5cyano6((2((4ethylphenyl)amino)2oxoethyl)sulfanyl)2methylN(2methylphenyl)4(thiophen2yl)14dihydropyridine3carboxamide
5cyano6((2((4ethylphenyl)amino)2oxoethyl)thio)2methyl4(thiophen2yl)N(otolyl)14dihydropyridine3carboxamide
5CYANO6(2(4ETHYLANILINO)2OXOETHYL)SULFANYL2METHYLN(2METHYLPHENYL)4THIOPHEN2YL14DIHYDROPYRIDINE3CARBOXAMIDE
CCC1=CC=C(C=C1)NC(=O)CSC2=C(C(C(=C(N2)C)C(=O)NC3=CC=CC=C3C)C4=CC=CS4)C#N
InChI=1SC29H28N4O2S2c1420111321(141220)3225(34)17372922(1630)27(24107153624)26(19(3)3129)28(35)3323965818(23)2h5152731H417H213H3(H3234)(H3335)
MFCD02236807
ZINC000097950448
ZINC000097950449

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Available files

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