3-[2,4-bis(oxidanylidene)-1H-quinazolin-3-yl]-4-chloranyl-N-(2-cyanoethyl)-N-phenyl-benzamide

Systemtic Name: 3-[2,4-bis(oxidanylidene)-1H-quinazolin-3-yl]-4-chloranyl-N-(2-cyanoethyl)-N-phenyl-benzamide Openeye Name: 4-chloro-N-(2-cyanoethyl)-3-(2,4-dioxo-1H-quinazolin-3-yl)-N-phenyl-benzamide CAS Name: 4-chloro-N-(2-cyanoethyl)-3-(2,4-dioxo-1H-quinazolin-3-yl)-N-phenylbenzamide IUPAC Name: 4-chloro-N-(2-cyanoethyl)-3-(2,4-dioxo-1H-quinazolin-3-yl)-N-phenylbenzamide Traditional Name: 4-chloro-N-(2-cyanoethyl)-3-(2,4-diketo-1H-quinazolin-3-yl)-N-phenyl-benzamide Formula: C24H17ClN4O3 MolecularWeight: 444.86978

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N(CCC#N)C(=O)C2=CC(=C(C=C2)Cl)N3C(=O)C4=CC=CC=C4NC3=O

Isomeric SMILES

C1=CC=C(C=C1)N(CCC#N)C(=O)C2=CC(=C(C=C2)Cl)N3C(=O)C4=CC=CC=C4NC3=O

InChI

InChI=1S/C24H17ClN4O3/c25-19-12-11-16(22(30)28(14-6-13-26)17-7-2-1-3-8-17)15-21(19)29-23(31)18-9-4-5-10-20(18)27-24(29)32/h1-5,7-12,15H,6,14H2,(H,27,32)