N-[2-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]ethyl]-1-thiophen-2-ylsulfonyl-piperidine-3-carboxamide

Systemtic Name: N-[2-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]ethyl]-1-thiophen-2-ylsulfonyl-piperidine-3-carboxamide Openeye Name: N-[2-[4-(2-methylthiazol-4-yl)phenyl]ethyl]-1-(2-thienylsulfonyl)piperidine-3-carboxamide CAS Name: N-[2-[4-(2-methyl-4-thiazolyl)phenyl]ethyl]-1-thiophen-2-ylsulfonyl-3-piperidinecarboxamide IUPAC Name: N-[2-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]ethyl]-1-thiophen-2-ylsulfonylpiperidine-3-carboxamide Traditional Name: N-[2-[4-(2-methylthiazol-4-yl)phenyl]ethyl]-1-(2-thienylsulfonyl)nipecotamide Formula: C22H25N3O3S3 MolecularWeight: 475.6472

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)C2=CC=C(C=C2)CCNC(=O)C3CCCN(C3)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

CC1=NC(=CS1)C2=CC=C(C=C2)CCNC(=O)C3CCCN(C3)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C22H25N3O3S3/c1-16-24-20(15-30-16)18-8-6-17(7-9-18)10-11-23-22(26)19-4-2-12-25(14-19)31(27,28)21-5-3-13-29-21/h3,5-9,13,15,19H,2,4,10-12,14H2,1H3,(H,23,26)