2-(4-chloranylpyrazol-1-yl)-1-[4-[(2-chlorophenyl)methyl]piperazin-1-yl]butan-1-one

Systemtic Name: 2-(4-chloranylpyrazol-1-yl)-1-[4-[(2-chlorophenyl)methyl]piperazin-1-yl]butan-1-one Openeye Name: 1-[4-[(2-chlorophenyl)methyl]piperazin-1-yl]-2-(4-chloropyrazol-1-yl)butan-1-one CAS Name: 1-[4-[(2-chlorophenyl)methyl]-1-piperazinyl]-2-(4-chloro-1-pyrazolyl)-1-butanone IUPAC Name: 1-[4-[(2-chlorophenyl)methyl]piperazin-1-yl]-2-(4-chloropyrazol-1-yl)butan-1-one Traditional Name: 1-[4-(2-chlorobenzyl)piperazino]-2-(4-chloropyrazol-1-yl)butan-1-one Formula: C18H22Cl2N4O MolecularWeight: 381.29948

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)N1CCN(CC1)CC2=CC=CC=C2Cl)N3C=C(C=N3)Cl

Isomeric SMILES

CCC(C(=O)N1CCN(CC1)CC2=CC=CC=C2Cl)N3C=C(C=N3)Cl

InChI

InChI=1S/C18H22Cl2N4O/c1-2-17(24-13-15(19)11-21-24)18(25)23-9-7-22(8-10-23)12-14-5-3-4-6-16(14)20/h3-6,11,13,17H,2,7-10,12H2,1H3