N-[4-(1-methylimidazol-2-yl)carbonylphenyl]-4-(1,2,4-triazol-1-ylmethyl)benzamide

Systemtic Name: N-[4-(1-methylimidazol-2-yl)carbonylphenyl]-4-(1,2,4-triazol-1-ylmethyl)benzamide Openeye Name: N-[4-(1-methylimidazole-2-carbonyl)phenyl]-4-(1,2,4-triazol-1-ylmethyl)benzamide CAS Name: N-[4-[(1-methyl-2-imidazolyl)-oxomethyl]phenyl]-4-(1,2,4-triazol-1-ylmethyl)benzamide IUPAC Name: N-[4-(1-methylimidazole-2-carbonyl)phenyl]-4-(1,2,4-triazol-1-ylmethyl)benzamide Traditional Name: N-[4-(1-methylimidazole-2-carbonyl)phenyl]-4-(1,2,4-triazol-1-ylmethyl)benzamide Formula: C21H18N6O2 MolecularWeight: 386.40662

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1C(=O)C2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)CN4C=NC=N4

Isomeric SMILES

CN1C=CN=C1C(=O)C2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)CN4C=NC=N4

InChI

InChI=1S/C21H18N6O2/c1-26-11-10-23-20(26)19(28)16-6-8-18(9-7-16)25-21(29)17-4-2-15(3-5-17)12-27-14-22-13-24-27/h2-11,13-14H,12H2,1H3,(H,25,29)