methyl 3-[(2E)-2-(1-cyano-3,3-dimethyl-2-oxidanylidene-butylidene)hydrazinyl]-4-(furan-2-ylmethylsulfonyl)thiophene-2-carboxylate

Systemtic Name: methyl 3-[(2E)-2-(1-cyano-3,3-dimethyl-2-oxidanylidene-butylidene)hydrazinyl]-4-(furan-2-ylmethylsulfonyl)thiophene-2-carboxylate Openeye Name: methyl 3-[(2E)-2-(1-cyano-3,3-dimethyl-2-oxo-butylidene)hydrazino]-4-(2-furylmethylsulfonyl)thiophene-2-carboxylate CAS Name: 3-[(2E)-2-(1-cyano-3,3-dimethyl-2-oxobutylidene)hydrazinyl]-4-(2-furanylmethylsulfonyl)-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[(2E)-2-(1-cyano-3,3-dimethyl-2-oxobutylidene)hydrazinyl]-4-(furan-2-ylmethylsulfonyl)thiophene-2-carboxylate Traditional Name: 3-[(N'E)-N'-(1-cyano-2-keto-3,3-dimethyl-butylidene)hydrazino]-4-(2-furfurylsulfonyl)thiophene-2-carboxylic acid methyl ester Formula: C18H19N3O6S2 MolecularWeight: 437.48996

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)C(=NNC1=C(SC=C1S(=O)(=O)CC2=CC=CO2)C(=O)OC)C#N

Isomeric SMILES

CC(C)(C)C(=O)/C(=N/NC1=C(SC=C1S(=O)(=O)CC2=CC=CO2)C(=O)OC)/C#N

InChI

InChI=1S/C18H19N3O6S2/c1-18(2,3)16(22)12(8-19)20-21-14-13(9-28-15(14)17(23)26-4)29(24,25)10-11-6-5-7-27-11/h5-7,9,21H,10H2,1-4H3/b20-12+