Vitas-M small molecule compound

2-{[3-(3-chlorophenyl)-4-oxo-3,4,6,7,8,9-hexahydropyrimido[4,5-b]quinolin-2-yl]sulfanyl}-N-(2-methylphenyl)acetamide

Catalog ID
STK555598
SMILES O=C(Nc1ccccc1C)CSc1nc2nc3CCCCc3cc2c(=O)n1c1cccc(c1)Cl

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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 C26H23ClN4O2S MW 491.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23ClN4O2S/c1-16-7-2-4-11-21(16)28-23(32)15-34-26-30-24-20(13-17-8-3-5-12-22(17)29-24)25(33)31(26)19-10-6-9-18(27)14-19/h2,4,6-7,9-11,13-14H,3,5,8,12,15H2,1H3,(H,28,32)
InChIKey
JJKOSFXPAHCKKR-UHFFFAOYSA-N
Synonyms
842960-92-3
2((3(3chlorophenyl)4oxo346789hexahydropyrimido(45b)quinolin2yl)sulfanyl)N(2methylphenyl)acetamide
2((3(3chlorophenyl)4oxo346789hexahydropyrimido(45b)quinolin2yl)thio)N(otolyl)acetamide
2((3(3chlorophenyl)4oxo6789tetrahydropyrimido(45b)quinolin2yl)sulfanyl)N(2methylphenyl)acetamide
842960923
CC1=CC=CC=C1NC(=O)CSC2=NC3=NC4=C(CCCC4)C=C3C(=O)N2C5=CC(=CC=C5)Cl
InChI=1SC26H23ClN4O2Sc1167241121(16)2823(32)153426302420(13178351222(17)2924)25(33)31(26)19106918(27)1419h24679111314H3581215H21H3(H2832)
MFCD04012312
ZINC000002403446
ZINC02403446
ZINC2403446

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.