Vitas-M small molecule compound

N-(2-ethoxyphenyl)-2-{[3-(furan-2-ylmethyl)-6-methyl-4-oxo-4,5-dihydro-3H-pyrrolo[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide

Catalog ID
STL093288
SMILES CCOc1ccccc1NC(=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 C22H22N4O4S MW 438.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N4O4S/c1-3-29-18-9-5-4-8-16(18)24-19(27)13-31-22-25-17-11-14(2)23-20(17)21(28)26(22)12-15-7-6-10-30-15/h4-11,23H,3,12-13H2,1-2H3,(H,24,27)
InChIKey
WWSCPKQCBJZQCM-UHFFFAOYSA-N
Synonyms

CCOC1=CC=CC=C1NC(=O)CSC2=NC3=C(C(=O)N2CC4=CC=CO4)NC(=C3)C
CCOc1ccccc1NC(=O)CSc1nc2cc((nH)c2c(=O)n1Cc1ccco1)C
InChI=1SC22H22N4O4Sc132918954816(18)2419(27)13312225171114(2)2320(17)21(28)26(22)121576103015h41123H31213H212H3(H2427)
MFCD18787422
N(2ethoxyphenyl)2((3(furan2ylmethyl)6methyl4oxo45dihydro3Hpyrrolo(32d)pyrimidin2yl)sulfanyl)acetamide
N(2ethoxyphenyl)2((3(furan2ylmethyl)6methyl4oxo5Hpyrrolo(32d)pyrimidin2yl)sulfanyl)acetamide
ZINC000067236339
ZINC67236339

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Available files

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