1-[4-[3-(4-methylsulfanylphenyl)carbonylpiperidin-1-yl]carbonylthiophen-2-yl]ethanone

Systemtic Name: 1-[4-[3-(4-methylsulfanylphenyl)carbonylpiperidin-1-yl]carbonylthiophen-2-yl]ethanone Openeye Name: 1-[4-[3-(4-methylsulfanylbenzoyl)piperidine-1-carbonyl]-2-thienyl]ethanone CAS Name: 1-[4-[[3-[[4-(methylthio)phenyl]-oxomethyl]-1-piperidinyl]-oxomethyl]-2-thiophenyl]ethanone IUPAC Name: 1-[4-[3-(4-methylsulfanylbenzoyl)piperidine-1-carbonyl]thiophen-2-yl]ethanone Traditional Name: 1-[4-[3-[4-(methylthio)benzoyl]piperidine-1-carbonyl]-2-thienyl]ethanone Formula: C20H21NO3S2 MolecularWeight: 387.51564

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CS1)C(=O)N2CCCC(C2)C(=O)C3=CC=C(C=C3)SC

Isomeric SMILES

CC(=O)C1=CC(=CS1)C(=O)N2CCCC(C2)C(=O)C3=CC=C(C=C3)SC

InChI

InChI=1S/C20H21NO3S2/c1-13(22)18-10-16(12-26-18)20(24)21-9-3-4-15(11-21)19(23)14-5-7-17(25-2)8-6-14/h5-8,10,12,15H,3-4,9,11H2,1-2H3