N-[3-(1,3-benzothiazol-2-yl)thiophen-2-yl]-1-(phenylsulfonyl)piperidine-3-carboxamide

Systemtic Name: N-[3-(1,3-benzothiazol-2-yl)thiophen-2-yl]-1-(phenylsulfonyl)piperidine-3-carboxamide Openeye Name: 1-(benzenesulfonyl)-N-[3-(1,3-benzothiazol-2-yl)-2-thienyl]piperidine-3-carboxamide CAS Name: 1-(benzenesulfonyl)-N-[3-(1,3-benzothiazol-2-yl)-2-thiophenyl]-3-piperidinecarboxamide IUPAC Name: 1-(benzenesulfonyl)-N-[3-(1,3-benzothiazol-2-yl)thiophen-2-yl]piperidine-3-carboxamide Traditional Name: N-[3-(1,3-benzothiazol-2-yl)-2-thienyl]-1-besyl-nipecotamide Formula: C23H21N3O3S3 MolecularWeight: 483.62614

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC=CC=C2)C(=O)NC3=C(C=CS3)C4=NC5=CC=CC=C5S4

Isomeric SMILES

C1CC(CN(C1)S(=O)(=O)C2=CC=CC=C2)C(=O)NC3=C(C=CS3)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C23H21N3O3S3/c27-21(16-7-6-13-26(15-16)32(28,29)17-8-2-1-3-9-17)25-22-18(12-14-30-22)23-24-19-10-4-5-11-20(19)31-23/h1-5,8-12,14,16H,6-7,13,15H2,(H,25,27)