methyl 2-[2-(4-methoxyphenyl)ethylcarbamothioylamino]-5-methyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[2-(4-methoxyphenyl)ethylcarbamothioylamino]-5-methyl-thiophene-3-carboxylate Openeye Name: methyl 2-[2-(4-methoxyphenyl)ethylcarbamothioylamino]-5-methyl-thiophene-3-carboxylate CAS Name: 2-[[[2-(4-methoxyphenyl)ethylamino]-sulfanylidenemethyl]amino]-5-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[2-(4-methoxyphenyl)ethylcarbamothioylamino]-5-methylthiophene-3-carboxylate Traditional Name: 2-[2-(4-methoxyphenyl)ethylthiocarbamoylamino]-5-methyl-thiophene-3-carboxylic acid methyl ester Formula: C17H20N2O3S2 MolecularWeight: 364.4823

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)NC(=S)NCCC2=CC=C(C=C2)OC)C(=O)OC

Isomeric SMILES

CC1=CC(=C(S1)NC(=S)NCCC2=CC=C(C=C2)OC)C(=O)OC

InChI

InChI=1S/C17H20N2O3S2/c1-11-10-14(16(20)22-3)15(24-11)19-17(23)18-9-8-12-4-6-13(21-2)7-5-12/h4-7,10H,8-9H2,1-3H3,(H2,18,19,23)