4,5-dimethyl-2-[(3,4,5-trimethoxyphenyl)carbonylcarbamothioylamino]thiophene-3-carboxamide

Systemtic Name: 4,5-dimethyl-2-[(3,4,5-trimethoxyphenyl)carbonylcarbamothioylamino]thiophene-3-carboxamide Openeye Name: 4,5-dimethyl-2-[(3,4,5-trimethoxybenzoyl)carbamothioylamino]thiophene-3-carboxamide CAS Name: 4,5-dimethyl-2-[[[[oxo-(3,4,5-trimethoxyphenyl)methyl]amino]-sulfanylidenemethyl]amino]-3-thiophenecarboxamide IUPAC Name: 4,5-dimethyl-2-[(3,4,5-trimethoxybenzoyl)carbamothioylamino]thiophene-3-carboxamide Traditional Name: 4,5-dimethyl-2-[(3,4,5-trimethoxybenzoyl)thiocarbamoylamino]thiophene-3-carboxamide Formula: C18H21N3O5S2 MolecularWeight: 423.50644

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)N)NC(=S)NC(=O)C2=CC(=C(C(=C2)OC)OC)OC)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)N)NC(=S)NC(=O)C2=CC(=C(C(=C2)OC)OC)OC)C

InChI

InChI=1S/C18H21N3O5S2/c1-8-9(2)28-17(13(8)15(19)22)21-18(27)20-16(23)10-6-11(24-3)14(26-5)12(7-10)25-4/h6-7H,1-5H3,(H2,19,22)(H2,20,21,23,27)