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

Systemtic Name: N-(3-azanyl-3-oxidanylidene-propyl)-12-oxidanylidene-N-phenyl-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazoline-3-carboxamide Openeye Name: N-(3-amino-3-oxo-propyl)-12-oxo-N-phenyl-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazoline-3-carboxamide CAS Name: N-(3-amino-3-oxopropyl)-12-oxo-N-phenyl-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazoline-3-carboxamide IUPAC Name: N-(3-amino-3-oxopropyl)-12-oxo-N-phenyl-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazoline-3-carboxamide Traditional Name: N-(3-amino-3-keto-propyl)-12-keto-N-phenyl-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazoline-3-carboxamide Formula: C23H24N4O3 MolecularWeight: 404.46166

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=NC3=C(C=CC(=C3)C(=O)N(CCC(=O)N)C4=CC=CC=C4)C(=O)N2CC1

Isomeric SMILES

C1CCC2=NC3=C(C=CC(=C3)C(=O)N(CCC(=O)N)C4=CC=CC=C4)C(=O)N2CC1

InChI

InChI=1S/C23H24N4O3/c24-20(28)12-14-26(17-7-3-1-4-8-17)22(29)16-10-11-18-19(15-16)25-21-9-5-2-6-13-27(21)23(18)30/h1,3-4,7-8,10-11,15H,2,5-6,9,12-14H2,(H2,24,28)