Vitas-M small molecule compound
N-butyl-2-[(3-ethyl-6-methyl-4-oxo-4,5-dihydro-3H-pyrrolo[3,2-d]pyrimidin-2-yl)sulfanyl]acetamide
Catalog ID
STL084367
SMILES CCCCNC(=O)CSc1nc2cc([nH]c2c(=O)n1CC)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 C15H22N4O2S MW 322.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H22N4O2S/c1-4-6-7-16-12(20)9-22-15-18-11-8-10(3)17-13(11)14(21)19(15)5-2/h8,17H,4-7,9H2,1-3H3,(H,16,20)InChIKey
KPRWPRBLYWSAEE-UHFFFAOYSA-NSynonyms
CCCCNC(=O)CSC1=NC2=C(C(=O)N1CC)NC(=C2)C
CCCCNC(=O)CSc1nc2cc((nH)c2c(=O)n1CC)C
InChI=1SC15H22N4O2Sc14671612(20)922151811810(3)1713(11)14(21)19(15)52h817H479H213H3(H1620)
MFCD18202937
Nbutyl2((3ethyl6methyl4oxo45dihydro3Hpyrrolo(32d)pyrimidin2yl)sulfanyl)acetamide
Nbutyl2((3ethyl6methyl4oxo5Hpyrrolo(32d)pyrimidin2yl)sulfanyl)acetamide
ZINC000057521707
ZINC57521707
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