Vitas-M small molecule compound
5-cyano-4-(4-ethoxyphenyl)-6-({2-[(4-ethylphenyl)amino]-2-oxoethyl}sulfanyl)-2-methyl-N-phenyl-1,4-dihydropyridine-3-carboxamide
Catalog ID
STK886677
SMILES CCOc1ccc(cc1)C1C(=C(SCC(=O)Nc2ccc(cc2)CC)NC(=C1C(=O)Nc1ccccc1)C)C#N
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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 C32H32N4O3S MW 552.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H32N4O3S/c1-4-22-11-15-25(16-12-22)35-28(37)20-40-32-27(19-33)30(23-13-17-26(18-14-23)39-5-2)29(21(3)34-32)31(38)36-24-9-7-6-8-10-24/h6-18,30,34H,4-5,20H2,1-3H3,(H,35,37)(H,36,38)InChIKey
IYTNVRTWTSDNGS-UHFFFAOYSA-NSynonyms
5cyano4(4ethoxyphenyl)6((2((4ethylphenyl)amino)2oxoethyl)sulfanyl)2methylNphenyl14dihydropyridine3carboxamide
5cyano4(4ethoxyphenyl)6(2(4ethylanilino)2oxoethyl)sulfanyl2methylNphenyl14dihydropyridine3carboxamide
CCC1=CC=C(C=C1)NC(=O)CSC2=C(C(C(=C(N2)C)C(=O)NC3=CC=CC=C3)C4=CC=C(C=C4)OCC)C#N
InChI=1SC32H32N4O3Sc1422111525(161222)3528(37)20403227(1933)30(23131726(181423)3952)29(21(3)3432)31(38)362497681024h6183034H4520H213H3(H3537)(H3638)
MFCD10087209
ZINC000102719318
ZINC000102719323
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