ethyl 4-(4-methoxyphenyl)-2-(propylcarbamothioylamino)thiophene-3-carboxylate

Systemtic Name: ethyl 4-(4-methoxyphenyl)-2-(propylcarbamothioylamino)thiophene-3-carboxylate Openeye Name: ethyl 4-(4-methoxyphenyl)-2-(propylcarbamothioylamino)thiophene-3-carboxylate CAS Name: 4-(4-methoxyphenyl)-2-[[propylamino(sulfanylidene)methyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-methoxyphenyl)-2-(propylcarbamothioylamino)thiophene-3-carboxylate Traditional Name: 4-(4-methoxyphenyl)-2-(propylthiocarbamoylamino)thiophene-3-carboxylic acid ethyl ester Formula: C18H22N2O3S2 MolecularWeight: 378.50888

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=S)NC1=C(C(=CS1)C2=CC=C(C=C2)OC)C(=O)OCC

Isomeric SMILES

CCCNC(=S)NC1=C(C(=CS1)C2=CC=C(C=C2)OC)C(=O)OCC

InChI

InChI=1S/C18H22N2O3S2/c1-4-10-19-18(24)20-16-15(17(21)23-5-2)14(11-25-16)12-6-8-13(22-3)9-7-12/h6-9,11H,4-5,10H2,1-3H3,(H2,19,20,24)