3-butyl-4-oxidanylidene-N-[(E)-1-[4-(1,2,4-triazol-1-yl)phenyl]ethylideneamino]phthalazine-1-carboxamide

Systemtic Name: 3-butyl-4-oxidanylidene-N-[(E)-1-[4-(1,2,4-triazol-1-yl)phenyl]ethylideneamino]phthalazine-1-carboxamide Openeye Name: 3-butyl-4-oxo-N-[(E)-1-[4-(1,2,4-triazol-1-yl)phenyl]ethylideneamino]phthalazine-1-carboxamide CAS Name: 3-butyl-4-oxo-N-[(E)-1-[4-(1,2,4-triazol-1-yl)phenyl]ethylideneamino]-1-phthalazinecarboxamide IUPAC Name: 3-butyl-4-oxo-N-[(E)-1-[4-(1,2,4-triazol-1-yl)phenyl]ethylideneamino]phthalazine-1-carboxamide Traditional Name: 3-butyl-4-keto-N-[(E)-1-[4-(1,2,4-triazol-1-yl)phenyl]ethylideneamino]phthalazine-1-carboxamide Formula: C23H23N7O2 MolecularWeight: 429.47442

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NN=C(C)C3=CC=C(C=C3)N4C=NC=N4

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N/N=C(\C)/C3=CC=C(C=C3)N4C=NC=N4

InChI

InChI=1S/C23H23N7O2/c1-3-4-13-29-23(32)20-8-6-5-7-19(20)21(28-29)22(31)27-26-16(2)17-9-11-18(12-10-17)30-15-24-14-25-30/h5-12,14-15H,3-4,13H2,1-2H3,(H,27,31)/b26-16+