ethyl 4-(4-methoxyphenyl)-2-(2-methylprop-2-enylcarbamothioylamino)thiophene-3-carboxylate

Systemtic Name: ethyl 4-(4-methoxyphenyl)-2-(2-methylprop-2-enylcarbamothioylamino)thiophene-3-carboxylate Openeye Name: ethyl 4-(4-methoxyphenyl)-2-(2-methylallylcarbamothioylamino)thiophene-3-carboxylate CAS Name: 4-(4-methoxyphenyl)-2-[[(2-methylprop-2-enylamino)-sulfanylidenemethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-methoxyphenyl)-2-(2-methylprop-2-enylcarbamothioylamino)thiophene-3-carboxylate Traditional Name: 4-(4-methoxyphenyl)-2-(2-methylallylthiocarbamoylamino)thiophene-3-carboxylic acid ethyl ester Formula: C19H22N2O3S2 MolecularWeight: 390.51958

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)OC)NC(=S)NCC(=C)C

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)OC)NC(=S)NCC(=C)C

InChI

InChI=1S/C19H22N2O3S2/c1-5-24-18(22)16-15(13-6-8-14(23-4)9-7-13)11-26-17(16)21-19(25)20-10-12(2)3/h6-9,11H,2,5,10H2,1,3-4H3,(H2,20,21,25)