2-[2-(3-chlorophenyl)-6-(1,4-diazepan-1-yl)-4-oxidanylidene-quinazolin-3-yl]-N-propan-2-yl-ethanamide

Systemtic Name: 2-[2-(3-chlorophenyl)-6-(1,4-diazepan-1-yl)-4-oxidanylidene-quinazolin-3-yl]-N-propan-2-yl-ethanamide Openeye Name: 2-[2-(3-chlorophenyl)-6-(1,4-diazepan-1-yl)-4-oxo-quinazolin-3-yl]-N-isopropyl-acetamide CAS Name: 2-[2-(3-chlorophenyl)-6-(1,4-diazepan-1-yl)-4-oxo-3-quinazolinyl]-N-propan-2-ylacetamide IUPAC Name: 2-[2-(3-chlorophenyl)-6-(1,4-diazepan-1-yl)-4-oxoquinazolin-3-yl]-N-propan-2-ylacetamide Traditional Name: 2-[2-(3-chlorophenyl)-6-(1,4-diazepan-1-yl)-4-keto-quinazolin-3-yl]-N-isopropyl-acetamide Formula: C24H28ClN5O2 MolecularWeight: 453.96442

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)CN1C(=NC2=C(C1=O)C=C(C=C2)N3CCCNCC3)C4=CC(=CC=C4)Cl

Isomeric SMILES

CC(C)NC(=O)CN1C(=NC2=C(C1=O)C=C(C=C2)N3CCCNCC3)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C24H28ClN5O2/c1-16(2)27-22(31)15-30-23(17-5-3-6-18(25)13-17)28-21-8-7-19(14-20(21)24(30)32)29-11-4-9-26-10-12-29/h3,5-8,13-14,16,26H,4,9-12,15H2,1-2H3,(H,27,31)