N-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,3-thiazol-2-yl]-1-thiophen-2-ylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,3-thiazol-2-yl]-1-thiophen-2-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)thiazol-2-yl]-1-(2-thienylsulfonyl)piperidine-4-carboxamide CAS Name: N-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-thiazolyl]-1-thiophen-2-ylsulfonyl-4-piperidinecarboxamide IUPAC Name: N-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,3-thiazol-2-yl]-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)thiazol-2-yl]-1-(2-thienylsulfonyl)isonipecotamide Formula: C21H21N3O5S3 MolecularWeight: 491.60354

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=NC(=CS2)C3=CC4=C(C=C3)OCCO4)S(=O)(=O)C5=CC=CS5

Isomeric SMILES

C1CN(CCC1C(=O)NC2=NC(=CS2)C3=CC4=C(C=C3)OCCO4)S(=O)(=O)C5=CC=CS5

InChI

InChI=1S/C21H21N3O5S3/c25-20(14-5-7-24(8-6-14)32(26,27)19-2-1-11-30-19)23-21-22-16(13-31-21)15-3-4-17-18(12-15)29-10-9-28-17/h1-4,11-14H,5-10H2,(H,22,23,25)