Vitas-M small molecule compound
N-(2-bromobenzyl)-2-{[3-(furan-2-ylmethyl)-6-methyl-4-oxo-4,5-dihydro-3H-pyrrolo[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide
Catalog ID
STL093333
SMILES O=C(CSc1nc2cc([nH]c2c(=O)n1Cc1ccco1)C)NCc1ccccc1Br
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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 C21H19BrN4O3S MW 487.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19BrN4O3S/c1-13-9-17-19(24-13)20(28)26(11-15-6-4-8-29-15)21(25-17)30-12-18(27)23-10-14-5-2-3-7-16(14)22/h2-9,24H,10-12H2,1H3,(H,23,27)InChIKey
JXSJOMFRDHCGHV-UHFFFAOYSA-NSynonyms
CC1=CC2=C(N1)C(=O)N(C(=N2)SCC(=O)NCC3=CC=CC=C3Br)CC4=CC=CO4
InChI=1SC21H19BrN4O3Sc11391719(2413)20(28)26(11156482915)21(2517)301218(27)231014523716(14)22h2924H1012H21H3(H2327)
MFCD18787467
N((2bromophenyl)methyl)2((3(furan2ylmethyl)6methyl4oxo5Hpyrrolo(32d)pyrimidin2yl)sulfanyl)acetamide
N(2bromobenzyl)2((3(furan2ylmethyl)6methyl4oxo45dihydro3Hpyrrolo(32d)pyrimidin2yl)sulfanyl)acetamide
O=C(CSc1nc2cc((nH)c2c(=O)n1Cc1ccco1)C)NCc1ccccc1Br
ZINC000067236513
ZINC67236513
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