Vitas-M small molecule compound
methyl 2-({[3-(3,4-dimethylphenyl)-2,4-dioxo-3,4-dihydrothieno[3,2-d]pyrimidin-1(2H)-yl]acetyl}amino)benzoate
Catalog ID
STL077444
SMILES COC(=O)c1ccccc1NC(=O)Cn1c2ccsc2c(=O)n(c1=O)c1ccc(c(c1)C)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 C24H21N3O5S MW 463.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H21N3O5S/c1-14-8-9-16(12-15(14)2)27-22(29)21-19(10-11-33-21)26(24(27)31)13-20(28)25-18-7-5-4-6-17(18)23(30)32-3/h4-12H,13H2,1-3H3,(H,25,28)InChIKey
DTCXMXAATABUNX-UHFFFAOYSA-NSynonyms
CC1=C(C=C(C=C1)N2C(=O)C3=C(C=CS3)N(C2=O)CC(=O)NC4=CC=CC=C4C(=O)OC)C
InChI=1SC24H21N3O5Sc1148916(1215(14)2)2722(29)2119(10113321)26(24(27)31)1320(28)2518754617(18)23(30)323h412H13H213H3(H2528)
methyl2(((3(34dimethylphenyl)24dioxo34dihydrothieno(32d)pyrimidin1(2H)yl)acetyl)amino)benzoate
methyl2((2(3(34dimethylphenyl)24dioxothieno(32d)pyrimidin1yl)acetyl)amino)benzoate
MFCD18198671
ZINC000057491069
ZINC57491069
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