1-[4-(4-chlorophenyl)carbonylpiperazin-1-yl]-3-(1,2,4-triazol-1-yl)propan-1-one

Systemtic Name: 1-[4-(4-chlorophenyl)carbonylpiperazin-1-yl]-3-(1,2,4-triazol-1-yl)propan-1-one Openeye Name: 1-[4-(4-chlorobenzoyl)piperazin-1-yl]-3-(1,2,4-triazol-1-yl)propan-1-one CAS Name: 1-[4-[(4-chlorophenyl)-oxomethyl]-1-piperazinyl]-3-(1,2,4-triazol-1-yl)-1-propanone IUPAC Name: 1-[4-(4-chlorobenzoyl)piperazin-1-yl]-3-(1,2,4-triazol-1-yl)propan-1-one Traditional Name: 1-[4-(4-chlorobenzoyl)piperazino]-3-(1,2,4-triazol-1-yl)propan-1-one Formula: C16H18ClN5O2 MolecularWeight: 347.79942

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCN2C=NC=N2)C(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1CN(CCN1C(=O)CCN2C=NC=N2)C(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C16H18ClN5O2/c17-14-3-1-13(2-4-14)16(24)21-9-7-20(8-10-21)15(23)5-6-22-12-18-11-19-22/h1-4,11-12H,5-10H2