N'-(4-methylphenyl)carbonyl-12-oxidanylidene-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazoline-3-carbohydrazide

Systemtic Name: N'-(4-methylphenyl)carbonyl-12-oxidanylidene-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazoline-3-carbohydrazide Openeye Name: N'-(4-methylbenzoyl)-12-oxo-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazoline-3-carbohydrazide CAS Name: N'-[(4-methylphenyl)-oxomethyl]-12-oxo-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazoline-3-carbohydrazide IUPAC Name: N'-(4-methylbenzoyl)-12-oxo-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazoline-3-carbohydrazide Traditional Name: 12-keto-N'-p-toluoyl-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazoline-3-carbohydrazide Formula: C22H22N4O3 MolecularWeight: 390.43508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NNC(=O)C2=CC3=C(C=C2)C(=O)N4CCCCCC4=N3

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NNC(=O)C2=CC3=C(C=C2)C(=O)N4CCCCCC4=N3

InChI

InChI=1S/C22H22N4O3/c1-14-6-8-15(9-7-14)20(27)24-25-21(28)16-10-11-17-18(13-16)23-19-5-3-2-4-12-26(19)22(17)29/h6-11,13H,2-5,12H2,1H3,(H,24,27)(H,25,28)