methyl 5-(diethylcarbamoyl)-2-[[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]carbothioylamino]-4-methyl-thiophene-3-carboxylate

Systemtic Name: methyl 5-(diethylcarbamoyl)-2-[[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]carbothioylamino]-4-methyl-thiophene-3-carboxylate Openeye Name: methyl 5-(diethylcarbamoyl)-2-[[4-(4-methoxyphenyl)sulfonylpiperazine-1-carbothioyl]amino]-4-methyl-thiophene-3-carboxylate CAS Name: 5-[diethylamino(oxo)methyl]-2-[[[4-(4-methoxyphenyl)sulfonyl-1-piperazinyl]-sulfanylidenemethyl]amino]-4-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-(diethylcarbamoyl)-2-[[4-(4-methoxyphenyl)sulfonylpiperazine-1-carbothioyl]amino]-4-methylthiophene-3-carboxylate Traditional Name: 5-(diethylcarbamoyl)-2-[[4-(4-methoxyphenyl)sulfonylpiperazine-1-carbothioyl]amino]-4-methyl-thiophene-3-carboxylic acid methyl ester Formula: C24H32N4O6S3 MolecularWeight: 568.72908

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=C(C(=C(S1)NC(=S)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)OC)C(=O)OC)C

Isomeric SMILES

CCN(CC)C(=O)C1=C(C(=C(S1)NC(=S)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)OC)C(=O)OC)C

InChI

InChI=1S/C24H32N4O6S3/c1-6-26(7-2)22(29)20-16(3)19(23(30)34-5)21(36-20)25-24(35)27-12-14-28(15-13-27)37(31,32)18-10-8-17(33-4)9-11-18/h8-11H,6-7,12-15H2,1-5H3,(H,25,35)