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

Systemtic Name: methyl 4-[2-(3,4-dimethoxyphenyl)ethylcarbamothioylamino]thiophene-3-carboxylate Openeye Name: methyl 4-[2-(3,4-dimethoxyphenyl)ethylcarbamothioylamino]thiophene-3-carboxylate CAS Name: 4-[[[2-(3,4-dimethoxyphenyl)ethylamino]-sulfanylidenemethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-[2-(3,4-dimethoxyphenyl)ethylcarbamothioylamino]thiophene-3-carboxylate Traditional Name: 4-(homoveratrylthiocarbamoylamino)thiophene-3-carboxylic acid methyl ester Formula: C17H20N2O4S2 MolecularWeight: 380.4817

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=S)NC2=CSC=C2C(=O)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=S)NC2=CSC=C2C(=O)OC)OC

InChI

InChI=1S/C17H20N2O4S2/c1-21-14-5-4-11(8-15(14)22-2)6-7-18-17(24)19-13-10-25-9-12(13)16(20)23-3/h4-5,8-10H,6-7H2,1-3H3,(H2,18,19,24)