Vitas-M small molecule compound
2-[(3,6-dimethyl-4-oxo-4,5-dihydro-3H-pyrrolo[3,2-d]pyrimidin-2-yl)sulfanyl]-N-(4-methoxybenzyl)acetamide
Catalog ID
STL084326
SMILES COc1ccc(cc1)CNC(=O)CSc1nc2cc([nH]c2c(=O)n1C)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 C18H20N4O3S MW 372.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20N4O3S/c1-11-8-14-16(20-11)17(24)22(2)18(21-14)26-10-15(23)19-9-12-4-6-13(25-3)7-5-12/h4-8,20H,9-10H2,1-3H3,(H,19,23)InChIKey
AHKRTYCJIJFLMK-UHFFFAOYSA-NSynonyms
2((36dimethyl4oxo45dihydro3Hpyrrolo(32d)pyrimidin2yl)sulfanyl)N(4methoxybenzyl)acetamide
2((36dimethyl4oxo5Hpyrrolo(32d)pyrimidin2yl)sulfanyl)N((4methoxyphenyl)methyl)acetamide
CC1=CC2=C(N1)C(=O)N(C(=N2)SCC(=O)NCC3=CC=C(C=C3)OC)C
COc1ccc(cc1)CNC(=O)CSc1nc2cc((nH)c2c(=O)n1C)C
InChI=1SC18H20N4O3Sc11181416(2011)17(24)22(2)18(2114)261015(23)199124613(253)7512h4820H910H213H3(H1923)
MFCD18202896
ZINC000057521522
ZINC57521522
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