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

Systemtic Name: 1-methyl-N-[2-(2-prop-2-enoxyethylsulfanyl)-1,3-benzothiazol-6-yl]piperidine-3-carboxamide Openeye Name: N-[2-(2-allyloxyethylsulfanyl)-1,3-benzothiazol-6-yl]-1-methyl-piperidine-3-carboxamide CAS Name: 1-methyl-N-[2-(2-prop-2-enoxyethylthio)-1,3-benzothiazol-6-yl]-3-piperidinecarboxamide IUPAC Name: 1-methyl-N-[2-(2-prop-2-enoxyethylsulfanyl)-1,3-benzothiazol-6-yl]piperidine-3-carboxamide Traditional Name: N-[2-(2-allyloxyethylthio)-1,3-benzothiazol-6-yl]-1-methyl-nipecotamide Formula: C19H25N3O2S2 MolecularWeight: 391.5507

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCCC(C1)C(=O)NC2=CC3=C(C=C2)N=C(S3)SCCOCC=C

Isomeric SMILES

CN1CCCC(C1)C(=O)NC2=CC3=C(C=C2)N=C(S3)SCCOCC=C

InChI

InChI=1S/C19H25N3O2S2/c1-3-9-24-10-11-25-19-21-16-7-6-15(12-17(16)26-19)20-18(23)14-5-4-8-22(2)13-14/h3,6-7,12,14H,1,4-5,8-11,13H2,2H3,(H,20,23)