4-oxidanylidene-N-[(Z)-[1-(phenylmethyl)pyrazol-4-yl]methylideneamino]-3-propyl-phthalazine-1-carboxamide

Systemtic Name: 4-oxidanylidene-N-[(Z)-[1-(phenylmethyl)pyrazol-4-yl]methylideneamino]-3-propyl-phthalazine-1-carboxamide Openeye Name: N-[(Z)-(1-benzylpyrazol-4-yl)methyleneamino]-4-oxo-3-propyl-phthalazine-1-carboxamide CAS Name: 4-oxo-N-[(Z)-[1-(phenylmethyl)-4-pyrazolyl]methylideneamino]-3-propyl-1-phthalazinecarboxamide IUPAC Name: N-[(Z)-(1-benzylpyrazol-4-yl)methylideneamino]-4-oxo-3-propylphthalazine-1-carboxamide Traditional Name: N-[(Z)-(1-benzylpyrazol-4-yl)methyleneamino]-4-keto-3-propyl-phthalazine-1-carboxamide Formula: C23H22N6O2 MolecularWeight: 414.45978

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NN=CC3=CN(N=C3)CC4=CC=CC=C4

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N/N=C\C3=CN(N=C3)CC4=CC=CC=C4

InChI

InChI=1S/C23H22N6O2/c1-2-12-29-23(31)20-11-7-6-10-19(20)21(27-29)22(30)26-24-13-18-14-25-28(16-18)15-17-8-4-3-5-9-17/h3-11,13-14,16H,2,12,15H2,1H3,(H,26,30)/b24-13-