Vitas-M small molecule compound
3-{[3-(4-methylbenzyl)-2,4-dioxo-3,4-dihydrothieno[3,2-d]pyrimidin-1(2H)-yl]acetyl}benzonitrile
Catalog ID
STL074076
SMILES N#Cc1cccc(c1)C(=O)Cn1c2ccsc2c(=O)n(c1=O)Cc1ccc(cc1)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 C23H17N3O3S MW 415.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H17N3O3S/c1-15-5-7-16(8-6-15)13-26-22(28)21-19(9-10-30-21)25(23(26)29)14-20(27)18-4-2-3-17(11-18)12-24/h2-11H,13-14H2,1H3InChIKey
JHXDFYVCZFXUQK-UHFFFAOYSA-NSynonyms
3((3(4methylbenzyl)24dioxo34dihydrothieno(32d)pyrimidin1(2H)yl)acetyl)benzonitrile
3(2(3((4methylphenyl)methyl)24dioxothieno(32d)pyrimidin1yl)acetyl)benzonitrile
CC1=CC=C(C=C1)CN2C(=O)C3=C(C=CS3)N(C2=O)CC(=O)C4=CC=CC(=C4)C#N
InChI=1SC23H17N3O3Sc1155716(8615)132622(28)2119(9103021)25(23(26)29)1420(27)1842317(1118)1224h211H1314H21H3
MFCD18195477
ZINC000057486223
ZINC57486223
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