N-(3-piperidin-1-ylsulfonylphenyl)-2-[[5-(thiophen-2-ylmethyl)-1H-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-(3-piperidin-1-ylsulfonylphenyl)-2-[[5-(thiophen-2-ylmethyl)-1H-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-[3-(1-piperidylsulfonyl)phenyl]-2-[[5-(2-thienylmethyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-[3-(1-piperidinylsulfonyl)phenyl]-2-[[5-(thiophen-2-ylmethyl)-1H-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-(3-piperidin-1-ylsulfonylphenyl)-2-[[5-(thiophen-2-ylmethyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-(3-piperidinosulfonylphenyl)-2-[[5-(2-thenyl)-1H-1,2,4-triazol-3-yl]thio]acetamide Formula: C20H23N5O3S3 MolecularWeight: 477.62332

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)CSC3=NNC(=N3)CC4=CC=CS4

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)CSC3=NNC(=N3)CC4=CC=CS4

InChI

InChI=1S/C20H23N5O3S3/c26-19(14-30-20-22-18(23-24-20)13-16-7-5-11-29-16)21-15-6-4-8-17(12-15)31(27,28)25-9-2-1-3-10-25/h4-8,11-12H,1-3,9-10,13-14H2,(H,21,26)(H,22,23,24)