2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-1-[3-(4-phenylpiperazin-1-yl)piperidin-1-yl]ethanone

Systemtic Name: 2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-1-[3-(4-phenylpiperazin-1-yl)piperidin-1-yl]ethanone Openeye Name: 2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-1-[3-(4-phenylpiperazin-1-yl)-1-piperidyl]ethanone CAS Name: 2-[(4-methyl-1,2,4-triazol-3-yl)thio]-1-[3-(4-phenyl-1-piperazinyl)-1-piperidinyl]ethanone IUPAC Name: 2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-1-[3-(4-phenylpiperazin-1-yl)piperidin-1-yl]ethanone Traditional Name: 2-[(4-methyl-1,2,4-triazol-3-yl)thio]-1-[3-(4-phenylpiperazino)piperidino]ethanone Formula: C20H28N6OS MolecularWeight: 400.54092

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NN=C1SCC(=O)N2CCCC(C2)N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CN1C=NN=C1SCC(=O)N2CCCC(C2)N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C20H28N6OS/c1-23-16-21-22-20(23)28-15-19(27)26-9-5-8-18(14-26)25-12-10-24(11-13-25)17-6-3-2-4-7-17/h2-4,6-7,16,18H,5,8-15H2,1H3