N-(2,4-dimethoxyphenyl)-2-(thiophen-2-ylmethylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: N-(2,4-dimethoxyphenyl)-2-(thiophen-2-ylmethylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: N-(2,4-dimethoxyphenyl)-2-(2-thienylmethylamino)-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: N-(2,4-dimethoxyphenyl)-2-(thiophen-2-ylmethylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: N-(2,4-dimethoxyphenyl)-2-(thiophen-2-ylmethylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: N-(2,4-dimethoxyphenyl)-2-(2-thenylamino)-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C22H24N2O3S2 MolecularWeight: 428.56756

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC(=O)C2=C(SC3=C2CCCC3)NCC4=CC=CS4)OC

Isomeric SMILES

COC1=CC(=C(C=C1)NC(=O)C2=C(SC3=C2CCCC3)NCC4=CC=CS4)OC

InChI

InChI=1S/C22H24N2O3S2/c1-26-14-9-10-17(18(12-14)27-2)24-21(25)20-16-7-3-4-8-19(16)29-22(20)23-13-15-6-5-11-28-15/h5-6,9-12,23H,3-4,7-8,13H2,1-2H3,(H,24,25)