Vitas-M small molecule compound
methyl 6-({2-[(4-acetylphenyl)amino]-2-oxoethyl}sulfanyl)-4-(2-chlorophenyl)-5-cyano-2-methyl-1,4-dihydropyridine-3-carboxylate
Catalog ID
STK839517
SMILES COC(=O)C1=C(C)NC(=C(C1c1ccccc1Cl)C#N)SCC(=O)Nc1ccc(cc1)C(=O)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 C25H22ClN3O4S MW 495.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22ClN3O4S/c1-14-22(25(32)33-3)23(18-6-4-5-7-20(18)26)19(12-27)24(28-14)34-13-21(31)29-17-10-8-16(9-11-17)15(2)30/h4-11,23,28H,13H2,1-3H3,(H,29,31)InChIKey
AQKHVSBPPCAXAN-UHFFFAOYSA-NSynonyms
370849-33-5370849335
CC1=C(C(C(=C(N1)SCC(=O)NC2=CC=C(C=C2)C(=O)C)C#N)C3=CC=CC=C3Cl)C(=O)OC
InChI=1SC25H22ClN3O4Sc11422(25(32)333)23(18645720(18)26)19(1227)24(2814)341321(31)291710816(91117)15(2)30h4112328H13H213H3(H2931)
methyl6((2((4acetylphenyl)amino)2oxoethyl)sulfanyl)4(2chlorophenyl)5cyano2methyl14dihydropyridine3carboxylate
METHYL6((2((4ACETYLPHENYL)AMINO)2OXOETHYL)THIO)4(2CHLOROPHENYL)5CYANO2METHYL14DIHYDROPYRIDINE3CARBOXYLATE
METHYL6(2(4ACETYLANILINO)2OXOETHYL)SULFANYL4(2CHLOROPHENYL)5CYANO2METHYL14DIHYDROPYRIDINE3CARBOXYLATE
MFCD02999758
ZINC000001250803
ZINC000001250804
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