N-[3-[2-(4-chlorophenyl)ethanoyl-(phenylmethyl)amino]propyl]-4-oxidanylidene-1H-quinazoline-2-carboxamide

Systemtic Name: N-[3-[2-(4-chlorophenyl)ethanoyl-(phenylmethyl)amino]propyl]-4-oxidanylidene-1H-quinazoline-2-carboxamide Openeye Name: N-[3-[benzyl-[2-(4-chlorophenyl)acetyl]amino]propyl]-4-oxo-1H-quinazoline-2-carboxamide CAS Name: N-[3-[[2-(4-chlorophenyl)-1-oxoethyl]-(phenylmethyl)amino]propyl]-4-oxo-1H-quinazoline-2-carboxamide IUPAC Name: N-[3-[benzyl-[2-(4-chlorophenyl)acetyl]amino]propyl]-4-oxo-1H-quinazoline-2-carboxamide Traditional Name: N-[3-[benzyl-[2-(4-chlorophenyl)acetyl]amino]propyl]-4-keto-1H-quinazoline-2-carboxamide Formula: C27H25ClN4O3 MolecularWeight: 488.9654

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(CCCNC(=O)C2=NC(=O)C3=CC=CC=C3N2)C(=O)CC4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC=C(C=C1)CN(CCCNC(=O)C2=NC(=O)C3=CC=CC=C3N2)C(=O)CC4=CC=C(C=C4)Cl

InChI

InChI=1S/C27H25ClN4O3/c28-21-13-11-19(12-14-21)17-24(33)32(18-20-7-2-1-3-8-20)16-6-15-29-27(35)25-30-23-10-5-4-9-22(23)26(34)31-25/h1-5,7-14H,6,15-18H2,(H,29,35)(H,30,31,34)