methyl 5-methyl-2-[(3,4,5-trimethoxyphenyl)carbamothioylamino]thiophene-3-carboxylate

Systemtic Name: methyl 5-methyl-2-[(3,4,5-trimethoxyphenyl)carbamothioylamino]thiophene-3-carboxylate Openeye Name: methyl 5-methyl-2-[(3,4,5-trimethoxyphenyl)carbamothioylamino]thiophene-3-carboxylate CAS Name: 5-methyl-2-[[sulfanylidene-(3,4,5-trimethoxyanilino)methyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-methyl-2-[(3,4,5-trimethoxyphenyl)carbamothioylamino]thiophene-3-carboxylate Traditional Name: 5-methyl-2-[(3,4,5-trimethoxyphenyl)thiocarbamoylamino]thiophene-3-carboxylic acid methyl ester Formula: C17H20N2O5S2 MolecularWeight: 396.4811

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)NC(=S)NC2=CC(=C(C(=C2)OC)OC)OC)C(=O)OC

Isomeric SMILES

CC1=CC(=C(S1)NC(=S)NC2=CC(=C(C(=C2)OC)OC)OC)C(=O)OC

InChI

InChI=1S/C17H20N2O5S2/c1-9-6-11(16(20)24-5)15(26-9)19-17(25)18-10-7-12(21-2)14(23-4)13(8-10)22-3/h6-8H,1-5H3,(H2,18,19,25)