Vitas-M small molecule compound
prop-2-en-1-yl 6-({2-[(3-acetylphenyl)amino]-2-oxoethyl}sulfanyl)-5-cyano-2-methyl-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxylate
Catalog ID
STK839563
SMILES C=CCOC(=O)C1=C(C)NC(=C(C1c1cccs1)C#N)SCC(=O)Nc1cccc(c1)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 C25H23N3O4S2 MW 493.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23N3O4S2/c1-4-10-32-25(31)22-15(2)27-24(19(13-26)23(22)20-9-6-11-33-20)34-14-21(30)28-18-8-5-7-17(12-18)16(3)29/h4-9,11-12,23,27H,1,10,14H2,2-3H3,(H,28,30)InChIKey
FQGJFZKEYRUQLC-UHFFFAOYSA-NSynonyms
370843-89-3370843893
allyl6((2((3acetylphenyl)amino)2oxoethyl)thio)5cyano2methyl4(thiophen2yl)14dihydropyridine3carboxylate
CC1=C(C(C(=C(N1)SCC(=O)NC2=CC=CC(=C2)C(=O)C)C#N)C3=CC=CS3)C(=O)OCC=C
InChI=1SC25H23N3O4S2c14103225(31)2215(2)2724(19(1326)23(22)2096113320)341421(30)281885717(1218)16(3)29h4911122327H11014H223H3(H2830)
MFCD02999138
prop2en1yl6((2((3acetylphenyl)amino)2oxoethyl)sulfanyl)5cyano2methyl4(thiophen2yl)14dihydropyridine3carboxylate
PROP2EN1YL6((2((3ACETYLPHENYL)AMINO)2OXOETHYL)SULFANYL)5CYANO2METHYL4THIOPHEN2YL14DIHYDROPYRIDINE3CARBOXYLATE
PROP2ENYL6(2(3ACETYLANILINO)2OXOETHYL)SULFANYL5CYANO2METHYL4THIOPHEN2YL14DIHYDROPYRIDINE3CARBOXYLATE
ZINC000001782952
ZINC000020025907
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