Vitas-M small molecule compound
N-(3-methoxyphenyl)-2-[(6-methyl-4-oxo-3-phenyl-4,5-dihydro-3H-pyrrolo[3,2-d]pyrimidin-2-yl)sulfanyl]acetamide
Catalog ID
STL103676
SMILES COc1cccc(c1)NC(=O)CSc1nc2cc([nH]c2c(=O)n1c1ccccc1)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 C22H20N4O3S MW 420.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20N4O3S/c1-14-11-18-20(23-14)21(28)26(16-8-4-3-5-9-16)22(25-18)30-13-19(27)24-15-7-6-10-17(12-15)29-2/h3-12,23H,13H2,1-2H3,(H,24,27)InChIKey
AKNHPKYIXOOLHH-UHFFFAOYSA-NSynonyms
CC1=CC2=C(N1)C(=O)N(C(=N2)SCC(=O)NC3=CC(=CC=C3)OC)C4=CC=CC=C4
COc1cccc(c1)NC(=O)CSc1nc2cc((nH)c2c(=O)n1c1ccccc1)C
InChI=1SC22H20N4O3Sc114111820(2314)21(28)26(168435916)22(2518)301319(27)2415761017(1215)292h31223H13H212H3(H2427)
MFCD20735278
N(3methoxyphenyl)2((6methyl4oxo3phenyl45dihydro3Hpyrrolo(32d)pyrimidin2yl)sulfanyl)acetamide
N(3methoxyphenyl)2((6methyl4oxo3phenyl5Hpyrrolo(32d)pyrimidin2yl)sulfanyl)acetamide
ZINC000067236634
ZINC67236634
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