3-(1-phenylpyrazol-4-yl)-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]propanamide

Systemtic Name: 3-(1-phenylpyrazol-4-yl)-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]propanamide Openeye Name: 3-(1-phenylpyrazol-4-yl)-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]propanamide CAS Name: 3-(1-phenyl-4-pyrazolyl)-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]propanamide IUPAC Name: 3-(1-phenylpyrazol-4-yl)-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]propanamide Traditional Name: 3-(1-phenylpyrazol-4-yl)-N-[4-(1,2,4-triazol-1-ylmethyl)benzyl]propionamide Formula: C22H22N6O MolecularWeight: 386.44968

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C=N2)CCC(=O)NCC3=CC=C(C=C3)CN4C=NC=N4

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C=N2)CCC(=O)NCC3=CC=C(C=C3)CN4C=NC=N4

InChI

InChI=1S/C22H22N6O/c29-22(11-10-20-13-25-28(15-20)21-4-2-1-3-5-21)24-12-18-6-8-19(9-7-18)14-27-17-23-16-26-27/h1-9,13,15-17H,10-12,14H2,(H,24,29)