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

Systemtic Name: N-[(Z)-[4-(azepan-1-yl)phenyl]methylideneamino]-3-ethyl-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-[(Z)-[4-(azepan-1-yl)phenyl]methyleneamino]-3-ethyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-[(Z)-[4-(1-azepanyl)phenyl]methylideneamino]-3-ethyl-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-[(Z)-[4-(azepan-1-yl)phenyl]methylideneamino]-3-ethyl-4-oxophthalazine-1-carboxamide Traditional Name: N-[(Z)-[4-(azepan-1-yl)benzylidene]amino]-3-ethyl-4-keto-phthalazine-1-carboxamide Formula: C24H27N5O2 MolecularWeight: 417.50348

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NN=CC3=CC=C(C=C3)N4CCCCCC4

Isomeric SMILES

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N/N=C\C3=CC=C(C=C3)N4CCCCCC4

InChI

InChI=1S/C24H27N5O2/c1-2-29-24(31)21-10-6-5-9-20(21)22(27-29)23(30)26-25-17-18-11-13-19(14-12-18)28-15-7-3-4-8-16-28/h5-6,9-14,17H,2-4,7-8,15-16H2,1H3,(H,26,30)/b25-17-