2-[[2-(2,5-dimethylphenyl)sulfonylethyl-methyl-amino]methyl]-1H-quinazolin-4-one

Systemtic Name: 2-[[2-(2,5-dimethylphenyl)sulfonylethyl-methyl-amino]methyl]-1H-quinazolin-4-one Openeye Name: 2-[[2-(2,5-dimethylphenyl)sulfonylethyl-methyl-amino]methyl]-1H-quinazolin-4-one CAS Name: 2-[[2-(2,5-dimethylphenyl)sulfonylethyl-methylamino]methyl]-1H-quinazolin-4-one IUPAC Name: 2-[[2-(2,5-dimethylphenyl)sulfonylethyl-methylamino]methyl]-1H-quinazolin-4-one Traditional Name: 2-[[2-(2,5-dimethylphenyl)sulfonylethyl-methyl-amino]methyl]-1H-quinazolin-4-one Formula: C20H23N3O3S MolecularWeight: 385.47992

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)CCN(C)CC2=NC(=O)C3=CC=CC=C3N2

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)CCN(C)CC2=NC(=O)C3=CC=CC=C3N2

InChI

InChI=1S/C20H23N3O3S/c1-14-8-9-15(2)18(12-14)27(25,26)11-10-23(3)13-19-21-17-7-5-4-6-16(17)20(24)22-19/h4-9,12H,10-11,13H2,1-3H3,(H,21,22,24)