N-[(E)-[3-[(2-chlorophenyl)carbonylamino]phenyl]methylideneamino]-4-oxidanylidene-3-propyl-phthalazine-1-carboxamide

Systemtic Name: N-[(E)-[3-[(2-chlorophenyl)carbonylamino]phenyl]methylideneamino]-4-oxidanylidene-3-propyl-phthalazine-1-carboxamide Openeye Name: N-[(E)-[3-[(2-chlorobenzoyl)amino]phenyl]methyleneamino]-4-oxo-3-propyl-phthalazine-1-carboxamide CAS Name: N-[(E)-[3-[[(2-chlorophenyl)-oxomethyl]amino]phenyl]methylideneamino]-4-oxo-3-propyl-1-phthalazinecarboxamide IUPAC Name: N-[(E)-[3-[(2-chlorobenzoyl)amino]phenyl]methylideneamino]-4-oxo-3-propylphthalazine-1-carboxamide Traditional Name: N-[(E)-[3-[(2-chlorobenzoyl)amino]benzylidene]amino]-4-keto-3-propyl-phthalazine-1-carboxamide Formula: C26H22ClN5O3 MolecularWeight: 487.93758

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NN=CC3=CC(=CC=C3)NC(=O)C4=CC=CC=C4Cl

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N/N=C/C3=CC(=CC=C3)NC(=O)C4=CC=CC=C4Cl

InChI

InChI=1S/C26H22ClN5O3/c1-2-14-32-26(35)20-11-4-3-10-19(20)23(31-32)25(34)30-28-16-17-8-7-9-18(15-17)29-24(33)21-12-5-6-13-22(21)27/h3-13,15-16H,2,14H2,1H3,(H,29,33)(H,30,34)/b28-16+