methyl 2-[1-(3,4-dimethoxyphenyl)ethylcarbamothioylamino]-5-(dimethylcarbamoyl)-4-methyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[1-(3,4-dimethoxyphenyl)ethylcarbamothioylamino]-5-(dimethylcarbamoyl)-4-methyl-thiophene-3-carboxylate Openeye Name: methyl 2-[1-(3,4-dimethoxyphenyl)ethylcarbamothioylamino]-5-(dimethylcarbamoyl)-4-methyl-thiophene-3-carboxylate CAS Name: 2-[[[1-(3,4-dimethoxyphenyl)ethylamino]-sulfanylidenemethyl]amino]-5-[dimethylamino(oxo)methyl]-4-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[1-(3,4-dimethoxyphenyl)ethylcarbamothioylamino]-5-(dimethylcarbamoyl)-4-methylthiophene-3-carboxylate Traditional Name: 2-[1-(3,4-dimethoxyphenyl)ethylthiocarbamoylamino]-5-(dimethylcarbamoyl)-4-methyl-thiophene-3-carboxylic acid methyl ester Formula: C21H27N3O5S2 MolecularWeight: 465.58618

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27N3O5S2/c1-11-16(20(26)29-7)18(31-17(11)19(25)24(3)4)23-21(30)22-12(2)13-8-9-14(27-5)15(10-13)28-6/h8-10,12H,1-7H3,(H2,22,23,30)