Vitas-M small molecule compound
2-(3-{(E)-[1-(3-chlorophenyl)-4,6-dioxo-2-sulfanyl-1,6-dihydropyrimidin-5(4H)-ylidene]methyl}-1H-indol-1-yl)-N-phenylacetamide
Catalog ID
STL058506
SMILES Clc1cccc(c1)N1C(=NC(=O)/C(=C\c2cn(c3c2cccc3)CC(=O)Nc2ccccc2)/C1=O)S
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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 C27H19ClN4O3S MW 514.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H19ClN4O3S/c28-18-7-6-10-20(14-18)32-26(35)22(25(34)30-27(32)36)13-17-15-31(23-12-5-4-11-21(17)23)16-24(33)29-19-8-2-1-3-9-19/h1-15H,16H2,(H,29,33)(H,30,34,36)/b22-13+InChIKey
ZGMITPPXFDGEQL-LPYMAVHISA-NSynonyms
2(3((E)(1(3chlorophenyl)46dioxo2sulfanyl16dihydropyrimidin5(4H)ylidene)methyl)1Hindol1yl)Nphenylacetamide
2(3((E)(1(3CHLOROPHENYL)46DIOXO2SULFANYLIDENE13DIAZINAN5YLIDENE)METHYL)INDOL1YL)NPHENYLACETAMIDE
C1=CC=C(C=C1)NC(=O)CN2C=C(C3=CC=CC=C32)C=C4C(=O)NC(=S)N(C4=O)C5=CC(=CC=C5)Cl
Clc1cccc(c1)N1C(=NC(=O)C(=Cc2cn(c3c2cccc3)CC(=O)Nc2ccccc2)C1=O)S
InChI=1SC27H19ClN4O3Sc2818761020(1418)3226(35)22(25(34)3027(32)36)13171531(2312541121(17)23)1624(33)29198213919h115H16H2(H2933)(H303436)b2213+
MFCD08734301
ZINC000008741261
ZINC8741261
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