ethyl 2-[2-(diethylcarbamothioylsulfanyl)ethanoylamino]-4-methyl-5-(phenylcarbamoyl)thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-(diethylcarbamothioylsulfanyl)ethanoylamino]-4-methyl-5-(phenylcarbamoyl)thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(diethylcarbamothioylsulfanyl)acetyl]amino]-4-methyl-5-(phenylcarbamoyl)thiophene-3-carboxylate CAS Name: 5-[anilino(oxo)methyl]-2-[[2-[[diethylamino(sulfanylidene)methyl]thio]-1-oxoethyl]amino]-4-methyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(diethylcarbamothioylsulfanyl)acetyl]amino]-4-methyl-5-(phenylcarbamoyl)thiophene-3-carboxylate Traditional Name: 2-[[2-(diethylthiocarbamoylthio)acetyl]amino]-4-methyl-5-(phenylcarbamoyl)thiophene-3-carboxylic acid ethyl ester Formula: C22H27N3O4S3 MolecularWeight: 493.66248

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=S)SCC(=O)NC1=C(C(=C(S1)C(=O)NC2=CC=CC=C2)C)C(=O)OCC

Isomeric SMILES

CCN(CC)C(=S)SCC(=O)NC1=C(C(=C(S1)C(=O)NC2=CC=CC=C2)C)C(=O)OCC

InChI

InChI=1S/C22H27N3O4S3/c1-5-25(6-2)22(30)31-13-16(26)24-20-17(21(28)29-7-3)14(4)18(32-20)19(27)23-15-11-9-8-10-12-15/h8-12H,5-7,13H2,1-4H3,(H,23,27)(H,24,26)