3-[2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethyl]-8-methyl-quinazolin-4-one

Systemtic Name: 3-[2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethyl]-8-methyl-quinazolin-4-one Openeye Name: 3-[2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-2-oxo-ethyl]-8-methyl-quinazolin-4-one CAS Name: 3-[2-[4-(2,5-dimethylphenyl)sulfonyl-1-piperazinyl]-2-oxoethyl]-8-methyl-4-quinazolinone IUPAC Name: 3-[2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-2-oxoethyl]-8-methylquinazolin-4-one Traditional Name: 3-[2-[4-(2,5-dimethylphenyl)sulfonylpiperazino]-2-keto-ethyl]-8-methyl-quinazolin-4-one Formula: C23H26N4O4S MolecularWeight: 454.54194

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)N2CCN(CC2)C(=O)CN3C=NC4=C(C3=O)C=CC=C4C

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)N2CCN(CC2)C(=O)CN3C=NC4=C(C3=O)C=CC=C4C

InChI

InChI=1S/C23H26N4O4S/c1-16-7-8-17(2)20(13-16)32(30,31)27-11-9-25(10-12-27)21(28)14-26-15-24-22-18(3)5-4-6-19(22)23(26)29/h4-8,13,15H,9-12,14H2,1-3H3