ethyl 4-methyl-5-[(2-methylphenyl)carbamoyl]-2-(2-thiophen-2-ylethanoylcarbamothioylamino)thiophene-3-carboxylate

Systemtic Name: ethyl 4-methyl-5-[(2-methylphenyl)carbamoyl]-2-(2-thiophen-2-ylethanoylcarbamothioylamino)thiophene-3-carboxylate Openeye Name: ethyl 4-methyl-5-(o-tolylcarbamoyl)-2-[[2-(2-thienyl)acetyl]carbamothioylamino]thiophene-3-carboxylate CAS Name: 4-methyl-5-[(2-methylanilino)-oxomethyl]-2-[[[(1-oxo-2-thiophen-2-ylethyl)amino]-sulfanylidenemethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-5-[(2-methylphenyl)carbamoyl]-2-[(2-thiophen-2-ylacetyl)carbamothioylamino]thiophene-3-carboxylate Traditional Name: 4-methyl-5-(o-tolylcarbamoyl)-2-[[2-(2-thienyl)acetyl]thiocarbamoylamino]thiophene-3-carboxylic acid ethyl ester Formula: C23H23N3O4S3 MolecularWeight: 501.64142

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)NC2=CC=CC=C2C)NC(=S)NC(=O)CC3=CC=CS3

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)NC2=CC=CC=C2C)NC(=S)NC(=O)CC3=CC=CS3

InChI

InChI=1S/C23H23N3O4S3/c1-4-30-22(29)18-14(3)19(20(28)24-16-10-6-5-8-13(16)2)33-21(18)26-23(31)25-17(27)12-15-9-7-11-32-15/h5-11H,4,12H2,1-3H3,(H,24,28)(H2,25,26,27,31)