1-(4-ethanoylpiperazin-1-yl)-2-[(1-phenyl-5-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanone

Systemtic Name: 1-(4-ethanoylpiperazin-1-yl)-2-[(1-phenyl-5-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanone Openeye Name: 1-(4-acetylpiperazin-1-yl)-2-[(5-isopropyl-1-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanone CAS Name: 1-(4-acetyl-1-piperazinyl)-2-[(1-phenyl-5-propan-2-yl-1,2,4-triazol-3-yl)thio]ethanone IUPAC Name: 1-(4-acetylpiperazin-1-yl)-2-[(1-phenyl-5-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanone Traditional Name: 1-(4-acetylpiperazino)-2-[(5-isopropyl-1-phenyl-1,2,4-triazol-3-yl)thio]ethanone Formula: C19H25N5O2S MolecularWeight: 387.4991

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC(=NN1C2=CC=CC=C2)SCC(=O)N3CCN(CC3)C(=O)C

Isomeric SMILES

CC(C)C1=NC(=NN1C2=CC=CC=C2)SCC(=O)N3CCN(CC3)C(=O)C

InChI

InChI=1S/C19H25N5O2S/c1-14(2)18-20-19(21-24(18)16-7-5-4-6-8-16)27-13-17(26)23-11-9-22(10-12-23)15(3)25/h4-8,14H,9-13H2,1-3H3