N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-4-(1,2,4-triazol-1-yl)benzamide

Systemtic Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-4-(1,2,4-triazol-1-yl)benzamide Openeye Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-4-(1,2,4-triazol-1-yl)benzamide CAS Name: N-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)methyl]-4-(1,2,4-triazol-1-yl)benzamide IUPAC Name: N-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]-4-(1,2,4-triazol-1-yl)benzamide Traditional Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-4-(1,2,4-triazol-1-yl)benzamide Formula: C21H20N6O MolecularWeight: 372.4231

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)CNC(=O)C3=CC=C(C=C3)N4C=NC=N4

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)CNC(=O)C3=CC=C(C=C3)N4C=NC=N4

InChI

InChI=1S/C21H20N6O/c1-15-20(16(2)27(25-15)19-6-4-3-5-7-19)12-23-21(28)17-8-10-18(11-9-17)26-14-22-13-24-26/h3-11,13-14H,12H2,1-2H3,(H,23,28)