1-[2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-1,2,4-triazole-3-carbonitrile

Systemtic Name: 1-[2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-1,2,4-triazole-3-carbonitrile Openeye Name: 1-[2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxo-ethyl]-1,2,4-triazole-3-carbonitrile CAS Name: 1-[2-[4-(3-chlorophenyl)-1-piperazinyl]-2-oxoethyl]-1,2,4-triazole-3-carbonitrile IUPAC Name: 1-[2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxoethyl]-1,2,4-triazole-3-carbonitrile Traditional Name: 1-[2-[4-(3-chlorophenyl)piperazino]-2-keto-ethyl]-1,2,4-triazole-3-carbonitrile Formula: C15H15ClN6O MolecularWeight: 330.7722

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=CC=C2)Cl)C(=O)CN3C=NC(=N3)C#N

Isomeric SMILES

C1CN(CCN1C2=CC(=CC=C2)Cl)C(=O)CN3C=NC(=N3)C#N

InChI

InChI=1S/C15H15ClN6O/c16-12-2-1-3-13(8-12)20-4-6-21(7-5-20)15(23)10-22-11-18-14(9-17)19-22/h1-3,8,11H,4-7,10H2