2-azanyl-N-tert-butyl-3-(3,4,5-trimethoxyphenyl)carbonyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carbothioamide

Systemtic Name: 2-azanyl-N-tert-butyl-3-(3,4,5-trimethoxyphenyl)carbonyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carbothioamide Openeye Name: 2-amino-N-tert-butyl-3-(3,4,5-trimethoxybenzoyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carbothioamide CAS Name: 2-amino-N-tert-butyl-3-[oxo-(3,4,5-trimethoxyphenyl)methyl]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carbothioamide IUPAC Name: 2-amino-N-tert-butyl-3-(3,4,5-trimethoxybenzoyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carbothioamide Traditional Name: 2-amino-N-tert-butyl-3-(3,4,5-trimethoxybenzoyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carbothioamide Formula: C22H29N3O4S2 MolecularWeight: 463.61336

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=S)N1CCC2=C(C1)SC(=C2C(=O)C3=CC(=C(C(=C3)OC)OC)OC)N

Isomeric SMILES

CC(C)(C)NC(=S)N1CCC2=C(C1)SC(=C2C(=O)C3=CC(=C(C(=C3)OC)OC)OC)N

InChI

InChI=1S/C22H29N3O4S2/c1-22(2,3)24-21(30)25-8-7-13-16(11-25)31-20(23)17(13)18(26)12-9-14(27-4)19(29-6)15(10-12)28-5/h9-10H,7-8,11,23H2,1-6H3,(H,24,30)