Vitas-M small molecule compound
2-{[3-(furan-2-ylmethyl)-6-methyl-4-oxo-4,5-dihydro-3H-pyrrolo[3,2-d]pyrimidin-2-yl]sulfanyl}-N-[1-(3-methoxyphenyl)ethyl]acetamide
Catalog ID
STL099025
SMILES COc1cccc(c1)C(NC(=O)CSc1nc2cc([nH]c2c(=O)n1Cc1ccco1)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 C23H24N4O4S MW 452.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H24N4O4S/c1-14-10-19-21(24-14)22(29)27(12-18-8-5-9-31-18)23(26-19)32-13-20(28)25-15(2)16-6-4-7-17(11-16)30-3/h4-11,15,24H,12-13H2,1-3H3,(H,25,28)InChIKey
DGJQLDLJINDUPT-UHFFFAOYSA-NSynonyms
2((3(furan2ylmethyl)6methyl4oxo45dihydro3Hpyrrolo(32d)pyrimidin2yl)sulfanyl)N(1(3methoxyphenyl)ethyl)acetamide
2((3(furan2ylmethyl)6methyl4oxo5Hpyrrolo(32d)pyrimidin2yl)sulfanyl)N(1(3methoxyphenyl)ethyl)acetamide
CC1=CC2=C(N1)C(=O)N(C(=N2)SCC(=O)NC(C)C3=CC(=CC=C3)OC)CC4=CC=CO4
COc1cccc(c1)C(NC(=O)CSc1nc2cc((nH)c2c(=O)n1Cc1ccco1)C)C
InChI=1SC23H24N4O4Sc114101921(2414)22(29)27(12188593118)23(2619)321320(28)2515(2)1664717(1116)303h4111524H1213H213H3(H2528)
MFCD18790257
ZINC000067299699
ZINC000067299707
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