3-[4-[(4-chlorophenyl)-phenyl-methyl]piperazin-1-yl]-1H-1,2,4-triazol-5-amine

Systemtic Name: 3-[4-[(4-chlorophenyl)-phenyl-methyl]piperazin-1-yl]-1H-1,2,4-triazol-5-amine Openeye Name: 3-[4-[(4-chlorophenyl)-phenyl-methyl]piperazin-1-yl]-1H-1,2,4-triazol-5-amine CAS Name: 3-[4-[(4-chlorophenyl)-phenylmethyl]-1-piperazinyl]-1H-1,2,4-triazol-5-amine IUPAC Name: 3-[4-[(4-chlorophenyl)-phenylmethyl]piperazin-1-yl]-1H-1,2,4-triazol-5-amine Traditional Name: [3-[4-[(4-chlorophenyl)-phenyl-methyl]piperazino]-1H-1,2,4-triazol-5-yl]amine Formula: C19H21ClN6 MolecularWeight: 368.86324

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NNC(=N2)N)C(C3=CC=CC=C3)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1CN(CCN1C2=NNC(=N2)N)C(C3=CC=CC=C3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C19H21ClN6/c20-16-8-6-15(7-9-16)17(14-4-2-1-3-5-14)25-10-12-26(13-11-25)19-22-18(21)23-24-19/h1-9,17H,10-13H2,(H3,21,22,23,24)