diethyl 3-methyl-5-[1-(4-propylphenyl)ethylcarbamothioylamino]thiophene-2,4-dicarboxylate

Systemtic Name: diethyl 3-methyl-5-[1-(4-propylphenyl)ethylcarbamothioylamino]thiophene-2,4-dicarboxylate Openeye Name: diethyl 3-methyl-5-[1-(4-propylphenyl)ethylcarbamothioylamino]thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[[1-(4-propylphenyl)ethylamino]-sulfanylidenemethyl]amino]thiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 3-methyl-5-[1-(4-propylphenyl)ethylcarbamothioylamino]thiophene-2,4-dicarboxylate Traditional Name: 3-methyl-5-[1-(4-propylphenyl)ethylthiocarbamoylamino]thiophene-2,4-dicarboxylic acid diethyl ester Formula: C23H30N2O4S2 MolecularWeight: 462.6253

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)C(C)NC(=S)NC2=C(C(=C(S2)C(=O)OCC)C)C(=O)OCC

Isomeric SMILES

CCCC1=CC=C(C=C1)C(C)NC(=S)NC2=C(C(=C(S2)C(=O)OCC)C)C(=O)OCC

InChI

InChI=1S/C23H30N2O4S2/c1-6-9-16-10-12-17(13-11-16)15(5)24-23(30)25-20-18(21(26)28-7-2)14(4)19(31-20)22(27)29-8-3/h10-13,15H,6-9H2,1-5H3,(H2,24,25,30)