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

Systemtic Name: ethyl 5-(phenylmethyl)-2-[(3,4,5-trimethoxyphenyl)carbamothioylamino]thiophene-3-carboxylate Openeye Name: ethyl 5-benzyl-2-[(3,4,5-trimethoxyphenyl)carbamothioylamino]thiophene-3-carboxylate CAS Name: 5-(phenylmethyl)-2-[[sulfanylidene-(3,4,5-trimethoxyanilino)methyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-benzyl-2-[(3,4,5-trimethoxyphenyl)carbamothioylamino]thiophene-3-carboxylate Traditional Name: 5-benzyl-2-[(3,4,5-trimethoxyphenyl)thiocarbamoylamino]thiophene-3-carboxylic acid ethyl ester Formula: C24H26N2O5S2 MolecularWeight: 486.60364

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1)CC2=CC=CC=C2)NC(=S)NC3=CC(=C(C(=C3)OC)OC)OC

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1)CC2=CC=CC=C2)NC(=S)NC3=CC(=C(C(=C3)OC)OC)OC

InChI

InChI=1S/C24H26N2O5S2/c1-5-31-23(27)18-14-17(11-15-9-7-6-8-10-15)33-22(18)26-24(32)25-16-12-19(28-2)21(30-4)20(13-16)29-3/h6-10,12-14H,5,11H2,1-4H3,(H2,25,26,32)