1-methyl-N-[2-(2-thiophen-3-ylethylsulfanyl)-1,3-benzothiazol-6-yl]piperidine-3-carboxamide

Systemtic Name: 1-methyl-N-[2-(2-thiophen-3-ylethylsulfanyl)-1,3-benzothiazol-6-yl]piperidine-3-carboxamide Openeye Name: 1-methyl-N-[2-[2-(3-thienyl)ethylsulfanyl]-1,3-benzothiazol-6-yl]piperidine-3-carboxamide CAS Name: 1-methyl-N-[2-[2-(3-thiophenyl)ethylthio]-1,3-benzothiazol-6-yl]-3-piperidinecarboxamide IUPAC Name: 1-methyl-N-[2-(2-thiophen-3-ylethylsulfanyl)-1,3-benzothiazol-6-yl]piperidine-3-carboxamide Traditional Name: 1-methyl-N-[2-[2-(3-thienyl)ethylthio]-1,3-benzothiazol-6-yl]nipecotamide Formula: C20H23N3OS3 MolecularWeight: 417.61112

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCCC(C1)C(=O)NC2=CC3=C(C=C2)N=C(S3)SCCC4=CSC=C4

Isomeric SMILES

CN1CCCC(C1)C(=O)NC2=CC3=C(C=C2)N=C(S3)SCCC4=CSC=C4

InChI

InChI=1S/C20H23N3OS3/c1-23-8-2-3-15(12-23)19(24)21-16-4-5-17-18(11-16)27-20(22-17)26-10-7-14-6-9-25-13-14/h4-6,9,11,13,15H,2-3,7-8,10,12H2,1H3,(H,21,24)