N-(5-methyl-2-phenyl-pyrazol-3-yl)-12-oxidanylidene-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazoline-3-carboxamide

Systemtic Name: N-(5-methyl-2-phenyl-pyrazol-3-yl)-12-oxidanylidene-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazoline-3-carboxamide Openeye Name: N-(5-methyl-2-phenyl-pyrazol-3-yl)-12-oxo-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazoline-3-carboxamide CAS Name: N-(5-methyl-2-phenyl-3-pyrazolyl)-12-oxo-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazoline-3-carboxamide IUPAC Name: N-(5-methyl-2-phenylpyrazol-3-yl)-12-oxo-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazoline-3-carboxamide Traditional Name: 12-keto-N-(5-methyl-2-phenyl-pyrazol-3-yl)-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazoline-3-carboxamide Formula: C24H23N5O2 MolecularWeight: 413.47172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)NC(=O)C2=CC3=C(C=C2)C(=O)N4CCCCCC4=N3)C5=CC=CC=C5

Isomeric SMILES

CC1=NN(C(=C1)NC(=O)C2=CC3=C(C=C2)C(=O)N4CCCCCC4=N3)C5=CC=CC=C5

InChI

InChI=1S/C24H23N5O2/c1-16-14-22(29(27-16)18-8-4-2-5-9-18)26-23(30)17-11-12-19-20(15-17)25-21-10-6-3-7-13-28(21)24(19)31/h2,4-5,8-9,11-12,14-15H,3,6-7,10,13H2,1H3,(H,26,30)