N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1-thiophen-2-ylsulfonyl-piperidine-2-carboxamide

Systemtic Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1-thiophen-2-ylsulfonyl-piperidine-2-carboxamide Openeye Name: N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-1-(2-thienylsulfonyl)piperidine-2-carboxamide CAS Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1-thiophen-2-ylsulfonyl-2-piperidinecarboxamide IUPAC Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1-thiophen-2-ylsulfonylpiperidine-2-carboxamide Traditional Name: N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-1-(2-thienylsulfonyl)pipecolinamide Formula: C19H21N3O3S3 MolecularWeight: 435.58334

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)NC2=C(C3=C(S2)CCCC3)C#N)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

C1CCN(C(C1)C(=O)NC2=C(C3=C(S2)CCCC3)C#N)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C19H21N3O3S3/c20-12-14-13-6-1-2-8-16(13)27-19(14)21-18(23)15-7-3-4-10-22(15)28(24,25)17-9-5-11-26-17/h5,9,11,15H,1-4,6-8,10H2,(H,21,23)