methyl 3-[(2Z)-2-[2-(4-tert-butylphenyl)-1-cyano-2-oxidanylidene-ethylidene]hydrazinyl]-5-methylsulfanyl-4-propan-2-ylsulfonyl-thiophene-2-carboxylate

Systemtic Name: methyl 3-[(2Z)-2-[2-(4-tert-butylphenyl)-1-cyano-2-oxidanylidene-ethylidene]hydrazinyl]-5-methylsulfanyl-4-propan-2-ylsulfonyl-thiophene-2-carboxylate Openeye Name: methyl 3-[(2Z)-2-[2-(4-tert-butylphenyl)-1-cyano-2-oxo-ethylidene]hydrazino]-4-isopropylsulfonyl-5-methylsulfanyl-thiophene-2-carboxylate CAS Name: 3-[(2Z)-2-[2-(4-tert-butylphenyl)-1-cyano-2-oxoethylidene]hydrazinyl]-5-(methylthio)-4-propan-2-ylsulfonyl-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[(2Z)-2-[2-(4-tert-butylphenyl)-1-cyano-2-oxoethylidene]hydrazinyl]-5-methylsulfanyl-4-propan-2-ylsulfonylthiophene-2-carboxylate Traditional Name: 3-[(N'Z)-N'-[2-(4-tert-butylphenyl)-1-cyano-2-keto-ethylidene]hydrazino]-4-isopropylsulfonyl-5-(methylthio)thiophene-2-carboxylic acid methyl ester Formula: C23H27N3O5S3 MolecularWeight: 521.67258

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)C1=C(SC(=C1NN=C(C#N)C(=O)C2=CC=C(C=C2)C(C)(C)C)C(=O)OC)SC

Isomeric SMILES

CC(C)S(=O)(=O)C1=C(SC(=C1N/N=C(/C#N)\C(=O)C2=CC=C(C=C2)C(C)(C)C)C(=O)OC)SC

InChI

InChI=1S/C23H27N3O5S3/c1-13(2)34(29,30)20-17(19(21(28)31-6)33-22(20)32-7)26-25-16(12-24)18(27)14-8-10-15(11-9-14)23(3,4)5/h8-11,13,26H,1-7H3/b25-16-