6-(1,3-benzothiazol-2-yl)-N-(2-morpholin-4-yl-2-thiophen-2-yl-ethyl)cyclohex-3-ene-1-carboxamide

Systemtic Name: 6-(1,3-benzothiazol-2-yl)-N-(2-morpholin-4-yl-2-thiophen-2-yl-ethyl)cyclohex-3-ene-1-carboxamide Openeye Name: 6-(1,3-benzothiazol-2-yl)-N-[2-morpholino-2-(2-thienyl)ethyl]cyclohex-3-ene-1-carboxamide CAS Name: 6-(1,3-benzothiazol-2-yl)-N-[2-(4-morpholinyl)-2-thiophen-2-ylethyl]-1-cyclohex-3-enecarboxamide IUPAC Name: 6-(1,3-benzothiazol-2-yl)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)cyclohex-3-ene-1-carboxamide Traditional Name: 6-(1,3-benzothiazol-2-yl)-N-[2-morpholino-2-(2-thienyl)ethyl]cyclohex-3-ene-1-carboxamide Formula: C24H27N3O2S2 MolecularWeight: 453.62008

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(CNC(=O)C2CC=CCC2C3=NC4=CC=CC=C4S3)C5=CC=CS5

Isomeric SMILES

C1COCCN1C(CNC(=O)C2CC=CCC2C3=NC4=CC=CC=C4S3)C5=CC=CS5

InChI

InChI=1S/C24H27N3O2S2/c28-23(25-16-20(22-10-5-15-30-22)27-11-13-29-14-12-27)17-6-1-2-7-18(17)24-26-19-8-3-4-9-21(19)31-24/h1-5,8-10,15,17-18,20H,6-7,11-14,16H2,(H,25,28)