Vitas-M small molecule compound
N-methyl-2-{[6-methyl-3-(2-methylpropyl)-4-oxo-4,5-dihydro-3H-pyrrolo[3,2-d]pyrimidin-2-yl]sulfanyl}-N-(3-methylphenyl)acetamide
Catalog ID
STL103851
SMILES Cc1cccc(c1)N(C(=O)CSc1nc2cc([nH]c2c(=O)n1CC(C)C)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 C21H26N4O2S MW 398.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26N4O2S/c1-13(2)11-25-20(27)19-17(10-15(4)22-19)23-21(25)28-12-18(26)24(5)16-8-6-7-14(3)9-16/h6-10,13,22H,11-12H2,1-5H3InChIKey
ZLYFIBWVYMQDGM-UHFFFAOYSA-NSynonyms
CC1=CC(=CC=C1)N(C)C(=O)CSC2=NC3=C(C(=O)N2CC(C)C)NC(=C3)C
Cc1cccc(c1)N(C(=O)CSc1nc2cc((nH)c2c(=O)n1CC(C)C)C)C
InChI=1SC21H26N4O2Sc113(2)112520(27)1917(1015(4)2219)2321(25)281218(26)24(5)1686714(3)916h6101322H1112H215H3
MFCD20735453
Nmethyl2((6methyl3(2methylpropyl)4oxo45dihydro3Hpyrrolo(32d)pyrimidin2yl)sulfanyl)N(3methylphenyl)acetamide
Nmethyl2((6methyl3(2methylpropyl)4oxo5Hpyrrolo(32d)pyrimidin2yl)sulfanyl)N(3methylphenyl)acetamide
ZINC000067237820
ZINC67237820
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