N-[3-(4-fluorophenyl)sulfanylpropyl]-1-(5-methylthiophen-2-yl)sulfonyl-piperidine-3-carboxamide

Systemtic Name: N-[3-(4-fluorophenyl)sulfanylpropyl]-1-(5-methylthiophen-2-yl)sulfonyl-piperidine-3-carboxamide Openeye Name: N-[3-(4-fluorophenyl)sulfanylpropyl]-1-[(5-methyl-2-thienyl)sulfonyl]piperidine-3-carboxamide CAS Name: N-[3-[(4-fluorophenyl)thio]propyl]-1-[(5-methyl-2-thiophenyl)sulfonyl]-3-piperidinecarboxamide IUPAC Name: N-[3-(4-fluorophenyl)sulfanylpropyl]-1-(5-methylthiophen-2-yl)sulfonylpiperidine-3-carboxamide Traditional Name: N-[3-[(4-fluorophenyl)thio]propyl]-1-[(5-methyl-2-thienyl)sulfonyl]nipecotamide Formula: C20H25FN2O3S3 MolecularWeight: 456.617503

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)S(=O)(=O)N2CCCC(C2)C(=O)NCCCSC3=CC=C(C=C3)F

Isomeric SMILES

CC1=CC=C(S1)S(=O)(=O)N2CCCC(C2)C(=O)NCCCSC3=CC=C(C=C3)F

InChI

InChI=1S/C20H25FN2O3S3/c1-15-5-10-19(28-15)29(25,26)23-12-2-4-16(14-23)20(24)22-11-3-13-27-18-8-6-17(21)7-9-18/h5-10,16H,2-4,11-14H2,1H3,(H,22,24)