Vitas-M small molecule compound
N-(4-ethylphenyl)-2-{[3-(furan-2-ylmethyl)-6-methyl-4-oxo-4,5-dihydro-3H-pyrrolo[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide
Catalog ID
STL093258
SMILES CCc1ccc(cc1)NC(=O)CSc1nc2cc([nH]c2c(=O)n1Cc1ccco1)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 C22H22N4O3S MW 422.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N4O3S/c1-3-15-6-8-16(9-7-15)24-19(27)13-30-22-25-18-11-14(2)23-20(18)21(28)26(22)12-17-5-4-10-29-17/h4-11,23H,3,12-13H2,1-2H3,(H,24,27)InChIKey
LXKWJUPIQVZERT-UHFFFAOYSA-NSynonyms
CCC1=CC=C(C=C1)NC(=O)CSC2=NC3=C(C(=O)N2CC4=CC=CO4)NC(=C3)C
CCc1ccc(cc1)NC(=O)CSc1nc2cc((nH)c2c(=O)n1Cc1ccco1)C
InChI=1SC22H22N4O3Sc13156816(9715)2419(27)13302225181114(2)2320(18)21(28)26(22)121754102917h41123H31213H212H3(H2427)
MFCD18787392
N(4ethylphenyl)2((3(furan2ylmethyl)6methyl4oxo45dihydro3Hpyrrolo(32d)pyrimidin2yl)sulfanyl)acetamide
N(4ethylphenyl)2((3(furan2ylmethyl)6methyl4oxo5Hpyrrolo(32d)pyrimidin2yl)sulfanyl)acetamide
ZINC000067236228
ZINC67236228
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