3-[3-[4-(4-ethylphenyl)carbonylpiperazin-1-yl]-3-oxidanylidene-propyl]-8-methyl-quinazolin-4-one

Systemtic Name: 3-[3-[4-(4-ethylphenyl)carbonylpiperazin-1-yl]-3-oxidanylidene-propyl]-8-methyl-quinazolin-4-one Openeye Name: 3-[3-[4-(4-ethylbenzoyl)piperazin-1-yl]-3-oxo-propyl]-8-methyl-quinazolin-4-one CAS Name: 3-[3-[4-[(4-ethylphenyl)-oxomethyl]-1-piperazinyl]-3-oxopropyl]-8-methyl-4-quinazolinone IUPAC Name: 3-[3-[4-(4-ethylbenzoyl)piperazin-1-yl]-3-oxopropyl]-8-methylquinazolin-4-one Traditional Name: 3-[3-[4-(4-ethylbenzoyl)piperazino]-3-keto-propyl]-8-methyl-quinazolin-4-one Formula: C25H28N4O3 MolecularWeight: 432.51482

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)N2CCN(CC2)C(=O)CCN3C=NC4=C(C3=O)C=CC=C4C

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)N2CCN(CC2)C(=O)CCN3C=NC4=C(C3=O)C=CC=C4C

InChI

InChI=1S/C25H28N4O3/c1-3-19-7-9-20(10-8-19)24(31)28-15-13-27(14-16-28)22(30)11-12-29-17-26-23-18(2)5-4-6-21(23)25(29)32/h4-10,17H,3,11-16H2,1-2H3