N-(4,5-dimethyl-1,3-benzothiazol-2-yl)-N-(oxolan-2-ylmethyl)-1-thiophen-2-ylsulfonyl-piperidine-2-carboxamide

Systemtic Name: N-(4,5-dimethyl-1,3-benzothiazol-2-yl)-N-(oxolan-2-ylmethyl)-1-thiophen-2-ylsulfonyl-piperidine-2-carboxamide Openeye Name: N-(4,5-dimethyl-1,3-benzothiazol-2-yl)-N-(tetrahydrofuran-2-ylmethyl)-1-(2-thienylsulfonyl)piperidine-2-carboxamide CAS Name: N-(4,5-dimethyl-1,3-benzothiazol-2-yl)-N-(2-oxolanylmethyl)-1-thiophen-2-ylsulfonyl-2-piperidinecarboxamide IUPAC Name: N-(4,5-dimethyl-1,3-benzothiazol-2-yl)-N-(oxolan-2-ylmethyl)-1-thiophen-2-ylsulfonylpiperidine-2-carboxamide Traditional Name: N-(4,5-dimethyl-1,3-benzothiazol-2-yl)-N-(tetrahydrofurfuryl)-1-(2-thienylsulfonyl)pipecolinamide Formula: C24H29N3O4S3 MolecularWeight: 519.69976

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)SC(=N2)N(CC3CCCO3)C(=O)C4CCCCN4S(=O)(=O)C5=CC=CS5)C

Isomeric SMILES

CC1=C(C2=C(C=C1)SC(=N2)N(CC3CCCO3)C(=O)C4CCCCN4S(=O)(=O)C5=CC=CS5)C

InChI

InChI=1S/C24H29N3O4S3/c1-16-10-11-20-22(17(16)2)25-24(33-20)26(15-18-7-5-13-31-18)23(28)19-8-3-4-12-27(19)34(29,30)21-9-6-14-32-21/h6,9-11,14,18-19H,3-5,7-8,12-13,15H2,1-2H3