N-(3-ethynylphenyl)-1-(5-methylthiophen-2-yl)sulfonyl-piperidine-3-carboxamide

Systemtic Name: N-(3-ethynylphenyl)-1-(5-methylthiophen-2-yl)sulfonyl-piperidine-3-carboxamide Openeye Name: N-(3-ethynylphenyl)-1-[(5-methyl-2-thienyl)sulfonyl]piperidine-3-carboxamide CAS Name: N-(3-ethynylphenyl)-1-[(5-methyl-2-thiophenyl)sulfonyl]-3-piperidinecarboxamide IUPAC Name: N-(3-ethynylphenyl)-1-(5-methylthiophen-2-yl)sulfonylpiperidine-3-carboxamide Traditional Name: N-(3-ethynylphenyl)-1-[(5-methyl-2-thienyl)sulfonyl]nipecotamide Formula: C19H20N2O3S2 MolecularWeight: 388.5037

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)S(=O)(=O)N2CCCC(C2)C(=O)NC3=CC=CC(=C3)C#C

Isomeric SMILES

CC1=CC=C(S1)S(=O)(=O)N2CCCC(C2)C(=O)NC3=CC=CC(=C3)C#C

InChI

InChI=1S/C19H20N2O3S2/c1-3-15-6-4-8-17(12-15)20-19(22)16-7-5-11-21(13-16)26(23,24)18-10-9-14(2)25-18/h1,4,6,8-10,12,16H,5,7,11,13H2,2H3,(H,20,22)