N-(3-chlorophenyl)-12-oxidanylidene-N-propyl-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazoline-3-carboxamide

Systemtic Name: N-(3-chlorophenyl)-12-oxidanylidene-N-propyl-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazoline-3-carboxamide Openeye Name: N-(3-chlorophenyl)-12-oxo-N-propyl-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazoline-3-carboxamide CAS Name: N-(3-chlorophenyl)-12-oxo-N-propyl-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazoline-3-carboxamide IUPAC Name: N-(3-chlorophenyl)-12-oxo-N-propyl-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazoline-3-carboxamide Traditional Name: N-(3-chlorophenyl)-12-keto-N-propyl-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazoline-3-carboxamide Formula: C23H24ClN3O2 MolecularWeight: 409.90856

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C1=CC(=CC=C1)Cl)C(=O)C2=CC3=C(C=C2)C(=O)N4CCCCCC4=N3

Isomeric SMILES

CCCN(C1=CC(=CC=C1)Cl)C(=O)C2=CC3=C(C=C2)C(=O)N4CCCCCC4=N3

InChI

InChI=1S/C23H24ClN3O2/c1-2-12-26(18-8-6-7-17(24)15-18)22(28)16-10-11-19-20(14-16)25-21-9-4-3-5-13-27(21)23(19)29/h6-8,10-11,14-15H,2-5,9,12-13H2,1H3