2-phenylsulfanyl-1-[4-[(1,3,5-trimethylpyrazol-4-yl)methyl]piperazin-1-yl]ethanone

Systemtic Name: 2-phenylsulfanyl-1-[4-[(1,3,5-trimethylpyrazol-4-yl)methyl]piperazin-1-yl]ethanone Openeye Name: 2-phenylsulfanyl-1-[4-[(1,3,5-trimethylpyrazol-4-yl)methyl]piperazin-1-yl]ethanone CAS Name: 2-(phenylthio)-1-[4-[(1,3,5-trimethyl-4-pyrazolyl)methyl]-1-piperazinyl]ethanone IUPAC Name: 2-phenylsulfanyl-1-[4-[(1,3,5-trimethylpyrazol-4-yl)methyl]piperazin-1-yl]ethanone Traditional Name: 2-(phenylthio)-1-[4-[(1,3,5-trimethylpyrazol-4-yl)methyl]piperazino]ethanone Formula: C19H26N4OS MolecularWeight: 358.50094

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)CN2CCN(CC2)C(=O)CSC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=NN1C)C)CN2CCN(CC2)C(=O)CSC3=CC=CC=C3

InChI

InChI=1S/C19H26N4OS/c1-15-18(16(2)21(3)20-15)13-22-9-11-23(12-10-22)19(24)14-25-17-7-5-4-6-8-17/h4-8H,9-14H2,1-3H3