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

Systemtic Name: methyl 3-[(2E)-2-(1-cyano-2-oxidanylidene-2-phenyl-ethylidene)hydrazinyl]-5-methylsulfanyl-4-propan-2-ylsulfonyl-thiophene-2-carboxylate Openeye Name: methyl 3-[(2E)-2-(1-cyano-2-oxo-2-phenyl-ethylidene)hydrazino]-4-isopropylsulfonyl-5-methylsulfanyl-thiophene-2-carboxylate CAS Name: 3-[(2E)-2-(1-cyano-2-oxo-2-phenylethylidene)hydrazinyl]-5-(methylthio)-4-propan-2-ylsulfonyl-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[(2E)-2-(1-cyano-2-oxo-2-phenylethylidene)hydrazinyl]-5-methylsulfanyl-4-propan-2-ylsulfonylthiophene-2-carboxylate Traditional Name: 3-[(N'E)-N'-(1-cyano-2-keto-2-phenyl-ethylidene)hydrazino]-4-isopropylsulfonyl-5-(methylthio)thiophene-2-carboxylic acid methyl ester Formula: C19H19N3O5S3 MolecularWeight: 465.56626

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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=CC=C2)C(=O)OC)SC

Isomeric SMILES

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

InChI

InChI=1S/C19H19N3O5S3/c1-11(2)30(25,26)17-14(16(18(24)27-3)29-19(17)28-4)22-21-13(10-20)15(23)12-8-6-5-7-9-12/h5-9,11,22H,1-4H3/b21-13+