2-(4-oxidanylidene-3H-phthalazin-1-yl)-N-[[6-(1,2,4-triazol-1-yl)pyridin-3-yl]methyl]ethanamide

Systemtic Name: 2-(4-oxidanylidene-3H-phthalazin-1-yl)-N-[[6-(1,2,4-triazol-1-yl)pyridin-3-yl]methyl]ethanamide Openeye Name: 2-(4-oxo-3H-phthalazin-1-yl)-N-[[6-(1,2,4-triazol-1-yl)-3-pyridyl]methyl]acetamide CAS Name: 2-(4-oxo-3H-phthalazin-1-yl)-N-[[6-(1,2,4-triazol-1-yl)-3-pyridinyl]methyl]acetamide IUPAC Name: 2-(4-oxo-3H-phthalazin-1-yl)-N-[[6-(1,2,4-triazol-1-yl)pyridin-3-yl]methyl]acetamide Traditional Name: 2-(4-keto-3H-phthalazin-1-yl)-N-[[6-(1,2,4-triazol-1-yl)-3-pyridyl]methyl]acetamide Formula: C18H15N7O2 MolecularWeight: 361.3574

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NNC2=O)CC(=O)NCC3=CN=C(C=C3)N4C=NC=N4

Isomeric SMILES

C1=CC=C2C(=C1)C(=NNC2=O)CC(=O)NCC3=CN=C(C=C3)N4C=NC=N4

InChI

InChI=1S/C18H15N7O2/c26-17(7-15-13-3-1-2-4-14(13)18(27)24-23-15)21-9-12-5-6-16(20-8-12)25-11-19-10-22-25/h1-6,8,10-11H,7,9H2,(H,21,26)(H,24,27)