1-[4-(4-ethylphenyl)carbonylpiperazin-1-yl]-4-(1,2,4-triazol-1-yl)butan-1-one

Systemtic Name: 1-[4-(4-ethylphenyl)carbonylpiperazin-1-yl]-4-(1,2,4-triazol-1-yl)butan-1-one Openeye Name: 1-[4-(4-ethylbenzoyl)piperazin-1-yl]-4-(1,2,4-triazol-1-yl)butan-1-one CAS Name: 1-[4-[(4-ethylphenyl)-oxomethyl]-1-piperazinyl]-4-(1,2,4-triazol-1-yl)-1-butanone IUPAC Name: 1-[4-(4-ethylbenzoyl)piperazin-1-yl]-4-(1,2,4-triazol-1-yl)butan-1-one Traditional Name: 1-[4-(4-ethylbenzoyl)piperazino]-4-(1,2,4-triazol-1-yl)butan-1-one Formula: C19H25N5O2 MolecularWeight: 355.4341

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)N2CCN(CC2)C(=O)CCCN3C=NC=N3

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)N2CCN(CC2)C(=O)CCCN3C=NC=N3

InChI

InChI=1S/C19H25N5O2/c1-2-16-5-7-17(8-6-16)19(26)23-12-10-22(11-13-23)18(25)4-3-9-24-15-20-14-21-24/h5-8,14-15H,2-4,9-13H2,1H3