N-[5-chloranyl-2-(1,2,4-triazol-1-yl)phenyl]-4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carboxamide

Systemtic Name: N-[5-chloranyl-2-(1,2,4-triazol-1-yl)phenyl]-4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carboxamide Openeye Name: 3-benzyl-N-[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]-4-oxo-phthalazine-1-carboxamide CAS Name: N-[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]-4-oxo-3-(phenylmethyl)-1-phthalazinecarboxamide IUPAC Name: 3-benzyl-N-[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]-4-oxophthalazine-1-carboxamide Traditional Name: 3-benzyl-N-[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]-4-keto-phthalazine-1-carboxamide Formula: C24H17ClN6O2 MolecularWeight: 456.88378

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)NC4=C(C=CC(=C4)Cl)N5C=NC=N5

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)NC4=C(C=CC(=C4)Cl)N5C=NC=N5

InChI

InChI=1S/C24H17ClN6O2/c25-17-10-11-21(31-15-26-14-27-31)20(12-17)28-23(32)22-18-8-4-5-9-19(18)24(33)30(29-22)13-16-6-2-1-3-7-16/h1-12,14-15H,13H2,(H,28,32)