Vitas-M small molecule compound
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-{[3-(4-fluorophenyl)-6-methyl-4-oxo-4,5-dihydro-3H-pyrrolo[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide
Catalog ID
STL093468
SMILES COc1cc(CCNC(=O)CSc2nc3cc([nH]c3c(=O)n2c2ccc(cc2)F)C)ccc1OC
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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 C25H25FN4O4S MW 496.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25FN4O4S/c1-15-12-19-23(28-15)24(32)30(18-7-5-17(26)6-8-18)25(29-19)35-14-22(31)27-11-10-16-4-9-20(33-2)21(13-16)34-3/h4-9,12-13,28H,10-11,14H2,1-3H3,(H,27,31)InChIKey
JIIJYQZRFPOMAK-UHFFFAOYSA-NSynonyms
CC1=CC2=C(N1)C(=O)N(C(=N2)SCC(=O)NCCC3=CC(=C(C=C3)OC)OC)C4=CC=C(C=C4)F
COc1cc(CCNC(=O)CSc2nc3cc((nH)c3c(=O)n2c2ccc(cc2)F)C)ccc1OC
InChI=1SC25H25FN4O4Sc115121923(2815)24(32)30(187517(26)6818)25(2919)351422(31)271110164920(332)21(1316)343h49121328H101114H213H3(H2731)
MFCD18787602
N(2(34dimethoxyphenyl)ethyl)2((3(4fluorophenyl)6methyl4oxo45dihydro3Hpyrrolo(32d)pyrimidin2yl)sulfanyl)acetamide
N(2(34dimethoxyphenyl)ethyl)2((3(4fluorophenyl)6methyl4oxo5Hpyrrolo(32d)pyrimidin2yl)sulfanyl)acetamide
ZINC000067237304
ZINC67237304
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