Vitas-M small molecule compound

2-(3-{(E)-[1-(3-chloro-4-methylphenyl)-4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene]methyl}-1H-indol-1-yl)-N-(2-methoxyethyl)acetamide

Catalog ID
STL371830
SMILES COCCNC(=O)Cn1cc(c2c1cccc2)/C=C/1\C(=O)NC(=S)N(C1=O)c1ccc(c(c1)Cl)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 C25H23ClN4O4S MW 511.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23ClN4O4S/c1-15-7-8-17(12-20(15)26)30-24(33)19(23(32)28-25(30)35)11-16-13-29(14-22(31)27-9-10-34-2)21-6-4-3-5-18(16)21/h3-8,11-13H,9-10,14H2,1-2H3,(H,27,31)(H,28,32,35)/b19-11+
InChIKey
KFWIWFIIPNPCLU-YBFXNURJSA-N
Synonyms

2(3((1(3CHLORO4METHYLPHENYL)46DIOXO2THIOXO(13DIHYDROPYRIMIDIN5YLIDENE))METHYL)INDOLYL)N(2METHOXYETHYL)ACETAMIDE
2(3((E)(1(3CHLORO4METHYLPHENYL)46DIOXO2SULFANYLIDENE13DIAZINAN5YLIDENE)METHYL)INDOL1YL)N(2METHOXYETHYL)ACETAMIDE
2(3((E)(1(3chloro4methylphenyl)46dioxo2thioxotetrahydropyrimidin5(2H)ylidene)methyl)1Hindol1yl)N(2methoxyethyl)acetamide
CC1=C(C=C(C=C1)N2C(=O)C(=CC3=CN(C4=CC=CC=C43)CC(=O)NCCOC)C(=O)NC2=S)Cl
COCCNC(=O)Cn1cc(c2c1cccc2)C=C1C(=O)NC(=S)N(C1=O)c1ccc(c(c1)Cl)C
InChI=1SC25H23ClN4O4Sc1157817(1220(15)26)3024(33)19(23(32)2825(30)35)11161329(1422(31)27910342)21643518(16)21h381113H91014H212H3(H2731)(H283235)b1911+
MFCD02734773
ZINC000006280496
ZINC06280496
ZINC6280496

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Available files

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