Vitas-M small molecule compound

N-(4-chlorophenyl)-5-cyano-6-({2-[(4-iodophenyl)amino]-2-oxoethyl}sulfanyl)-2-methyl-4-phenyl-1,4-dihydropyridine-3-carboxamide

Catalog ID
STK677312
SMILES N#CC1=C(SCC(=O)Nc2ccc(cc2)I)NC(=C(C1c1ccccc1)C(=O)Nc1ccc(cc1)Cl)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 C28H22ClIN4O2S MW 640.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H22ClIN4O2S/c1-17-25(27(36)34-22-11-7-19(29)8-12-22)26(18-5-3-2-4-6-18)23(15-31)28(32-17)37-16-24(35)33-21-13-9-20(30)10-14-21/h2-14,26,32H,16H2,1H3,(H,33,35)(H,34,36)
InChIKey
XXNPJVTWQDXRBF-UHFFFAOYSA-N
Synonyms

CC1=C(C(C(=C(N1)SCC(=O)NC2=CC=C(C=C2)I)C#N)C3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)Cl
InChI=1SC28H22ClIN4O2Sc11725(27(36)342211719(29)81222)26(185324618)23(1531)28(3217)371624(35)332113920(30)101421h2142632H16H21H3(H3335)(H3436)
MFCD02241285
N(4chlorophenyl)5cyano6((2((4iodophenyl)amino)2oxoethyl)sulfanyl)2methyl4phenyl14dihydropyridine3carboxamide
N(4chlorophenyl)5cyano6((2((4iodophenyl)amino)2oxoethyl)thio)2methyl4phenyl14dihydropyridine3carboxamide
N(4CHLOROPHENYL)5CYANO6(2(4IODOANILINO)2OXOETHYL)SULFANYL2METHYL4PHENYL14DIHYDROPYRIDINE3CARBOXAMIDE
ZINC000097999691
ZINC000097999692

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Available files

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