4-oxidanylidene-3-(phenylmethyl)-N-(1H-1,2,4-triazol-5-yl)phthalazine-1-carboxamide

Systemtic Name: 4-oxidanylidene-3-(phenylmethyl)-N-(1H-1,2,4-triazol-5-yl)phthalazine-1-carboxamide Openeye Name: 3-benzyl-4-oxo-N-(1H-1,2,4-triazol-5-yl)phthalazine-1-carboxamide CAS Name: 4-oxo-3-(phenylmethyl)-N-(1H-1,2,4-triazol-5-yl)-1-phthalazinecarboxamide IUPAC Name: 3-benzyl-4-oxo-N-(1H-1,2,4-triazol-5-yl)phthalazine-1-carboxamide Traditional Name: 3-benzyl-4-keto-N-(1H-1,2,4-triazol-5-yl)phthalazine-1-carboxamide Formula: C18H14N6O2 MolecularWeight: 346.34276

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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=NC=NN4

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)NC4=NC=NN4

InChI

InChI=1S/C18H14N6O2/c25-16(21-18-19-11-20-22-18)15-13-8-4-5-9-14(13)17(26)24(23-15)10-12-6-2-1-3-7-12/h1-9,11H,10H2,(H2,19,20,21,22,25)