4-phenyl-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]piperazine-1-carboxamide

Systemtic Name: 4-phenyl-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]piperazine-1-carboxamide Openeye Name: 4-phenyl-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]piperazine-1-carboxamide CAS Name: 4-phenyl-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]-1-piperazinecarboxamide IUPAC Name: 4-phenyl-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]piperazine-1-carboxamide Traditional Name: 4-phenyl-N-[4-(1,2,4-triazol-1-ylmethyl)benzyl]piperazine-1-carboxamide Formula: C21H24N6O MolecularWeight: 376.45486

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C(=O)NCC3=CC=C(C=C3)CN4C=NC=N4

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C(=O)NCC3=CC=C(C=C3)CN4C=NC=N4

InChI

InChI=1S/C21H24N6O/c28-21(26-12-10-25(11-13-26)20-4-2-1-3-5-20)23-14-18-6-8-19(9-7-18)15-27-17-22-16-24-27/h1-9,16-17H,10-15H2,(H,23,28)