Vitas-M small molecule compound
N-(3-methylphenyl)-2-{[5-(2-methylpropyl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-yl]sulfanyl}acetamide
Catalog ID
STK721382
SMILES CC(Cc1nc2sc3c(c2c2c1CCCC2)ncnc3SCC(=O)Nc1cccc(c1)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 C26H28N4OS2 MW 476.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H28N4OS2/c1-15(2)11-20-18-9-4-5-10-19(18)22-23-24(33-25(22)30-20)26(28-14-27-23)32-13-21(31)29-17-8-6-7-16(3)12-17/h6-8,12,14-15H,4-5,9-11,13H2,1-3H3,(H,29,31)InChIKey
VZKNRFZPBJINAV-UHFFFAOYSA-NSynonyms
385424-37-32((5isobutyl1234tetrahydropyrimido(4545)thieno(23c)isoquinolin8yl)thio)N(mtolyl)acetamide
385424373
CC1=CC(=CC=C1)NC(=O)CSC2=NC=NC3=C2SC4=NC(=C5CCCCC5=C34)CC(C)C
InChI=1SC26H28N4OS2c115(2)1120189451019(18)222324(3325(22)3020)26(28142723)321321(31)291786716(3)1217h68121415H4591113H213H3(H2931)
MFCD03286233
N(3methylphenyl)2((5(2methylpropyl)1234tetrahydropyrimido(4545)thieno(23c)isoquinolin8yl)sulfanyl)acetamide
ZINC000009086496
ZINC09086496
ZINC9086496
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