Vitas-M small molecule compound
N-benzyl-2-{[6-methyl-3-(4-methylphenyl)-4-oxo-4,5-dihydro-3H-pyrrolo[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide
Catalog ID
STL103709
SMILES O=C(NCc1ccccc1)CSc1nc2cc([nH]c2c(=O)n1c1ccc(cc1)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 C23H22N4O2S MW 418.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22N4O2S/c1-15-8-10-18(11-9-15)27-22(29)21-19(12-16(2)25-21)26-23(27)30-14-20(28)24-13-17-6-4-3-5-7-17/h3-12,25H,13-14H2,1-2H3,(H,24,28)InChIKey
SEGIQJZJHQSNMM-UHFFFAOYSA-NSynonyms
CC1=CC=C(C=C1)N2C(=O)C3=C(C=C(N3)C)N=C2SCC(=O)NCC4=CC=CC=C4
InChI=1SC23H22N4O2Sc11581018(11915)2722(29)2119(1216(2)2521)2623(27)301420(28)2413176435717h31225H1314H212H3(H2428)
MFCD20735311
Nbenzyl2((6methyl3(4methylphenyl)4oxo45dihydro3Hpyrrolo(32d)pyrimidin2yl)sulfanyl)acetamide
Nbenzyl2((6methyl3(4methylphenyl)4oxo5Hpyrrolo(32d)pyrimidin2yl)sulfanyl)acetamide
O=C(NCc1ccccc1)CSc1nc2cc((nH)c2c(=O)n1c1ccc(cc1)C)C
ZINC000067236934
ZINC67236934
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