ethyl 4-aminocarbonyl-5-[(3-ethylsulfanylphenyl)carbonylamino]-3-methyl-thiophene-2-carboxylate

Systemtic Name: ethyl 4-aminocarbonyl-5-[(3-ethylsulfanylphenyl)carbonylamino]-3-methyl-thiophene-2-carboxylate Openeye Name: ethyl 4-carbamoyl-5-[(3-ethylsulfanylbenzoyl)amino]-3-methyl-thiophene-2-carboxylate CAS Name: 4-carbamoyl-5-[[[3-(ethylthio)phenyl]-oxomethyl]amino]-3-methyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-carbamoyl-5-[(3-ethylsulfanylbenzoyl)amino]-3-methylthiophene-2-carboxylate Traditional Name: 4-carbamoyl-5-[[3-(ethylthio)benzoyl]amino]-3-methyl-thiophene-2-carboxylic acid ethyl ester Formula: C18H20N2O4S2 MolecularWeight: 392.4924

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)NC(=O)C2=CC(=CC=C2)SCC)C(=O)N)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)NC(=O)C2=CC(=CC=C2)SCC)C(=O)N)C

InChI

InChI=1S/C18H20N2O4S2/c1-4-24-18(23)14-10(3)13(15(19)21)17(26-14)20-16(22)11-7-6-8-12(9-11)25-5-2/h6-9H,4-5H2,1-3H3,(H2,19,21)(H,20,22)