N-[(Z)-[4-(azepan-1-yl)phenyl]methylideneamino]-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: N-[(Z)-[4-(azepan-1-yl)phenyl]methylideneamino]-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-[(Z)-[4-(azepan-1-yl)phenyl]methyleneamino]-3-methyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-[(Z)-[4-(1-azepanyl)phenyl]methylideneamino]-3-methyl-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-[(Z)-[4-(azepan-1-yl)phenyl]methylideneamino]-3-methyl-4-oxophthalazine-1-carboxamide Traditional Name: N-[(Z)-[4-(azepan-1-yl)benzylidene]amino]-4-keto-3-methyl-phthalazine-1-carboxamide Formula: C23H25N5O2 MolecularWeight: 403.4769

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NN=CC3=CC=C(C=C3)N4CCCCCC4

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N/N=C\C3=CC=C(C=C3)N4CCCCCC4

InChI

InChI=1S/C23H25N5O2/c1-27-23(30)20-9-5-4-8-19(20)21(26-27)22(29)25-24-16-17-10-12-18(13-11-17)28-14-6-2-3-7-15-28/h4-5,8-13,16H,2-3,6-7,14-15H2,1H3,(H,25,29)/b24-16-