Vitas-M small molecule compound
N-benzyl-2-{[3-(furan-2-ylmethyl)-6-methyl-4-oxo-4,5-dihydro-3H-pyrrolo[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide
Catalog ID
STL093245
SMILES O=C(NCc1ccccc1)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 C21H20N4O3S MW 408.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N4O3S/c1-14-10-17-19(23-14)20(27)25(12-16-8-5-9-28-16)21(24-17)29-13-18(26)22-11-15-6-3-2-4-7-15/h2-10,23H,11-13H2,1H3,(H,22,26)InChIKey
KATDPYRHTBQXIU-UHFFFAOYSA-NSynonyms
CC1=CC2=C(N1)C(=O)N(C(=N2)SCC(=O)NCC3=CC=CC=C3)CC4=CC=CO4
InChI=1SC21H20N4O3Sc114101719(2314)20(27)25(12168592816)21(2417)291318(26)2211156324715h21023H1113H21H3(H2226)
MFCD18787379
Nbenzyl2((3(furan2ylmethyl)6methyl4oxo45dihydro3Hpyrrolo(32d)pyrimidin2yl)sulfanyl)acetamide
Nbenzyl2((3(furan2ylmethyl)6methyl4oxo5Hpyrrolo(32d)pyrimidin2yl)sulfanyl)acetamide
O=C(NCc1ccccc1)CSc1nc2cc((nH)c2c(=O)n1Cc1ccco1)C
ZINC000067236185
ZINC67236185
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