1-[4-(4-ethanoylphenyl)piperazin-1-yl]-4-(1,2,4-triazol-1-yl)butan-1-one

Systemtic Name: 1-[4-(4-ethanoylphenyl)piperazin-1-yl]-4-(1,2,4-triazol-1-yl)butan-1-one Openeye Name: 1-[4-(4-acetylphenyl)piperazin-1-yl]-4-(1,2,4-triazol-1-yl)butan-1-one CAS Name: 1-[4-(4-acetylphenyl)-1-piperazinyl]-4-(1,2,4-triazol-1-yl)-1-butanone IUPAC Name: 1-[4-(4-acetylphenyl)piperazin-1-yl]-4-(1,2,4-triazol-1-yl)butan-1-one Traditional Name: 1-[4-(4-acetylphenyl)piperazino]-4-(1,2,4-triazol-1-yl)butan-1-one Formula: C18H23N5O2 MolecularWeight: 341.40752

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C(=O)CCCN3C=NC=N3

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C(=O)CCCN3C=NC=N3

InChI

InChI=1S/C18H23N5O2/c1-15(24)16-4-6-17(7-5-16)21-9-11-22(12-10-21)18(25)3-2-8-23-14-19-13-20-23/h4-7,13-14H,2-3,8-12H2,1H3