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

Systemtic Name: N-(4,5,6,7-tetrahydro-2,1-benzoxazol-3-yl)-1-thiophen-2-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-(4,5,6,7-tetrahydro-2,1-benzoxazol-3-yl)-1-(2-thienylsulfonyl)piperidine-4-carboxamide CAS Name: N-(4,5,6,7-tetrahydro-2,1-benzoxazol-3-yl)-1-thiophen-2-ylsulfonyl-4-piperidinecarboxamide IUPAC Name: N-(4,5,6,7-tetrahydro-2,1-benzoxazol-3-yl)-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-(4,5,6,7-tetrahydroanthranil-3-yl)-1-(2-thienylsulfonyl)isonipecotamide Formula: C17H21N3O4S2 MolecularWeight: 395.49634

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=NOC(=C2C1)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

C1CCC2=NOC(=C2C1)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C17H21N3O4S2/c21-16(18-17-13-4-1-2-5-14(13)19-24-17)12-7-9-20(10-8-12)26(22,23)15-6-3-11-25-15/h3,6,11-12H,1-2,4-5,7-10H2,(H,18,21)