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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=O)N(C1=O)CC(=O)N3CCN(CC3)C4=CC(=CC=C4)Cl

Isomeric SMILES

CN1C2=CC=CC=C2C(=O)N(C1=O)CC(=O)N3CCN(CC3)C4=CC(=CC=C4)Cl

InChI

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