2-[4-(2-propylsulfanylpyridin-3-yl)carbonylpiperazin-1-yl]-1-pyrrolidin-1-yl-ethanone

Systemtic Name: 2-[4-(2-propylsulfanylpyridin-3-yl)carbonylpiperazin-1-yl]-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-[4-(2-propylsulfanylpyridine-3-carbonyl)piperazin-1-yl]-1-pyrrolidin-1-yl-ethanone CAS Name: 2-[4-[oxo-[2-(propylthio)-3-pyridinyl]methyl]-1-piperazinyl]-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-[4-(2-propylsulfanylpyridine-3-carbonyl)piperazin-1-yl]-1-pyrrolidin-1-ylethanone Traditional Name: 2-[4-[2-(propylthio)nicotinoyl]piperazino]-1-pyrrolidino-ethanone Formula: C19H28N4O2S MolecularWeight: 376.51622

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=C(C=CC=N1)C(=O)N2CCN(CC2)CC(=O)N3CCCC3

Isomeric SMILES

CCCSC1=C(C=CC=N1)C(=O)N2CCN(CC2)CC(=O)N3CCCC3

InChI

InChI=1S/C19H28N4O2S/c1-2-14-26-18-16(6-5-7-20-18)19(25)23-12-10-21(11-13-23)15-17(24)22-8-3-4-9-22/h5-7H,2-4,8-15H2,1H3