Vitas-M small molecule compound

N-(4-chlorophenyl)-2-(3-{(Z)-[4,6-dioxo-1-(prop-2-en-1-yl)-2-thioxotetrahydropyrimidin-5(2H)-ylidene]methyl}-1H-indol-1-yl)acetamide

Catalog ID
STK190209
SMILES C=CCN1C(=S)NC(=O)/C(=C/c2cn(c3c2cccc3)CC(=O)Nc2ccc(cc2)Cl)/C1=O

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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 C24H19ClN4O3S MW 478.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H19ClN4O3S/c1-2-11-29-23(32)19(22(31)27-24(29)33)12-15-13-28(20-6-4-3-5-18(15)20)14-21(30)26-17-9-7-16(25)8-10-17/h2-10,12-13H,1,11,14H2,(H,26,30)(H,27,31,33)/b19-12-
InChIKey
PKKYSTQGPQNNOH-UNOMPAQXSA-N
Synonyms

2(3((46DIOXO1PROP2ENYL2THIOXO(13DIHYDROPYRIMIDIN5YLIDENE))METHYL)INDOLYL)N(4CHLOROPHENYL)ACETAMIDE
C=CCN1C(=O)C(=CC2=CN(C3=CC=CC=C32)CC(=O)NC4=CC=C(C=C4)Cl)C(=O)NC1=S
C=CCN1C(=S)NC(=O)C(=Cc2cn(c3c2cccc3)CC(=O)Nc2ccc(cc2)Cl)C1=O
InChI=1SC24H19ClN4O3Sc12112923(32)19(22(31)2724(29)33)12151328(20643518(15)20)1421(30)26179716(25)81017h2101213H11114H2(H2630)(H273133)b1912
MFCD03649151
N(4CHLOROPHENYL)2(3((Z)(46DIOXO1(PROP2EN1YL)2THIOXOTETRAHYDROPYRIMIDIN5(2H)YLIDENE)METHYL)1HINDOL1YL)ACETAMIDE
N(4CHLOROPHENYL)2(3((Z)(46DIOXO1PROP2ENYL2SULFANYLIDENE13DIAZINAN5YLIDENE)METHYL)INDOL1YL)ACETAMIDE
ZINC000008722752
ZINC08722752
ZINC8722752

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Available files

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