2-[[(2-chloranyl-7-methylsulfanyl-quinolin-3-yl)methyl-(2-methoxyethyl)amino]methyl]-1H-quinazolin-4-one

Systemtic Name: 2-[[(2-chloranyl-7-methylsulfanyl-quinolin-3-yl)methyl-(2-methoxyethyl)amino]methyl]-1H-quinazolin-4-one Openeye Name: 2-[[(2-chloro-7-methylsulfanyl-3-quinolyl)methyl-(2-methoxyethyl)amino]methyl]-1H-quinazolin-4-one CAS Name: 2-[[[2-chloro-7-(methylthio)-3-quinolinyl]methyl-(2-methoxyethyl)amino]methyl]-1H-quinazolin-4-one IUPAC Name: 2-[[(2-chloro-7-methylsulfanylquinolin-3-yl)methyl-(2-methoxyethyl)amino]methyl]-1H-quinazolin-4-one Traditional Name: 2-[[[2-chloro-7-(methylthio)-3-quinolyl]methyl-(2-methoxyethyl)amino]methyl]-1H-quinazolin-4-one Formula: C23H23ClN4O2S MolecularWeight: 454.97232

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Descriptors Computed from Structure

Canonical SMILES:

COCCN(CC1=C(N=C2C=C(C=CC2=C1)SC)Cl)CC3=NC(=O)C4=CC=CC=C4N3

Isomeric SMILES

COCCN(CC1=C(N=C2C=C(C=CC2=C1)SC)Cl)CC3=NC(=O)C4=CC=CC=C4N3

InChI

InChI=1S/C23H23ClN4O2S/c1-30-10-9-28(14-21-25-19-6-4-3-5-18(19)23(29)27-21)13-16-11-15-7-8-17(31-2)12-20(15)26-22(16)24/h3-8,11-12H,9-10,13-14H2,1-2H3,(H,25,27,29)