2-(4-methylphenyl)-1-[3-(pyrrolidin-1-ylmethyl)thiomorpholin-4-yl]ethanone

Systemtic Name: 2-(4-methylphenyl)-1-[3-(pyrrolidin-1-ylmethyl)thiomorpholin-4-yl]ethanone Openeye Name: 2-(p-tolyl)-1-[3-(pyrrolidin-1-ylmethyl)thiomorpholin-4-yl]ethanone CAS Name: 2-(4-methylphenyl)-1-[3-(1-pyrrolidinylmethyl)-4-thiomorpholinyl]ethanone IUPAC Name: 2-(4-methylphenyl)-1-[3-(pyrrolidin-1-ylmethyl)thiomorpholin-4-yl]ethanone Traditional Name: 2-(p-tolyl)-1-[3-(pyrrolidinomethyl)thiomorpholin-4-yl]ethanone Formula: C18H26N2OS MolecularWeight: 318.47684

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CC(=O)N2CCSCC2CN3CCCC3

Isomeric SMILES

CC1=CC=C(C=C1)CC(=O)N2CCSCC2CN3CCCC3

InChI

InChI=1S/C18H26N2OS/c1-15-4-6-16(7-5-15)12-18(21)20-10-11-22-14-17(20)13-19-8-2-3-9-19/h4-7,17H,2-3,8-14H2,1H3