2-[[4-(3-methylquinolin-8-yl)sulfonylpiperazin-1-yl]methyl]-1H-quinazolin-4-one

Systemtic Name: 2-[[4-(3-methylquinolin-8-yl)sulfonylpiperazin-1-yl]methyl]-1H-quinazolin-4-one Openeye Name: 2-[[4-[(3-methyl-8-quinolyl)sulfonyl]piperazin-1-yl]methyl]-1H-quinazolin-4-one CAS Name: 2-[[4-[(3-methyl-8-quinolinyl)sulfonyl]-1-piperazinyl]methyl]-1H-quinazolin-4-one IUPAC Name: 2-[[4-(3-methylquinolin-8-yl)sulfonylpiperazin-1-yl]methyl]-1H-quinazolin-4-one Traditional Name: 2-[[4-[(3-methyl-8-quinolyl)sulfonyl]piperazino]methyl]-1H-quinazolin-4-one Formula: C23H23N5O3S MolecularWeight: 449.52542

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C2C(=C1)C=CC=C2S(=O)(=O)N3CCN(CC3)CC4=NC(=O)C5=CC=CC=C5N4

Isomeric SMILES

CC1=CN=C2C(=C1)C=CC=C2S(=O)(=O)N3CCN(CC3)CC4=NC(=O)C5=CC=CC=C5N4

InChI

InChI=1S/C23H23N5O3S/c1-16-13-17-5-4-8-20(22(17)24-14-16)32(30,31)28-11-9-27(10-12-28)15-21-25-19-7-3-2-6-18(19)23(29)26-21/h2-8,13-14H,9-12,15H2,1H3,(H,25,26,29)