3-[1-[4-(3-chlorophenyl)piperazin-1-yl]-1-oxidanylidene-propan-2-yl]-1H-quinazoline-2,4-dione

Systemtic Name: 3-[1-[4-(3-chlorophenyl)piperazin-1-yl]-1-oxidanylidene-propan-2-yl]-1H-quinazoline-2,4-dione Openeye Name: 3-[2-[4-(3-chlorophenyl)piperazin-1-yl]-1-methyl-2-oxo-ethyl]-1H-quinazoline-2,4-dione CAS Name: 3-[1-[4-(3-chlorophenyl)-1-piperazinyl]-1-oxopropan-2-yl]-1H-quinazoline-2,4-dione IUPAC Name: 3-[1-[4-(3-chlorophenyl)piperazin-1-yl]-1-oxopropan-2-yl]-1H-quinazoline-2,4-dione Traditional Name: 3-[2-[4-(3-chlorophenyl)piperazino]-2-keto-1-methyl-ethyl]-1H-quinazoline-2,4-quinone Formula: C21H21ClN4O3 MolecularWeight: 412.86944

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)C2=CC(=CC=C2)Cl)N3C(=O)C4=CC=CC=C4NC3=O

Isomeric SMILES

CC(C(=O)N1CCN(CC1)C2=CC(=CC=C2)Cl)N3C(=O)C4=CC=CC=C4NC3=O

InChI

InChI=1S/C21H21ClN4O3/c1-14(26-20(28)17-7-2-3-8-18(17)23-21(26)29)19(27)25-11-9-24(10-12-25)16-6-4-5-15(22)13-16/h2-8,13-14H,9-12H2,1H3,(H,23,29)