ethyl (2E,4E)-5-azanyl-2-cyano-4-[(E)-1-methylsulfanyl-1-(phenylsulfamoyl)prop-1-en-2-yl]hexa-2,4-dienoate

Systemtic Name: ethyl (2E,4E)-5-azanyl-2-cyano-4-[(E)-1-methylsulfanyl-1-(phenylsulfamoyl)prop-1-en-2-yl]hexa-2,4-dienoate Openeye Name: ethyl (2E,4E)-5-amino-2-cyano-4-[(E)-1-methyl-2-methylsulfanyl-2-(phenylsulfamoyl)vinyl]hexa-2,4-dienoate CAS Name: (2E,4E)-5-amino-2-cyano-4-[(E)-1-(methylthio)-1-(phenylsulfamoyl)prop-1-en-2-yl]hexa-2,4-dienoic acid ethyl ester IUPAC Name: ethyl (2E,4E)-5-amino-2-cyano-4-[(E)-1-methylsulfanyl-1-(phenylsulfamoyl)prop-1-en-2-yl]hexa-2,4-dienoate Traditional Name: (2E,4E)-5-amino-2-cyano-4-[(E)-1-methyl-2-(methylthio)-2-(phenylsulfamoyl)vinyl]hexa-2,4-dienoic acid ethyl ester Formula: C19H23N3O4S2 MolecularWeight: 421.53362

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC(=C(C)N)C(=C(SC)S(=O)(=O)NC1=CC=CC=C1)C)C#N

Isomeric SMILES

CCOC(=O)/C(=C/C(=C(/C)\N)/C(=C(\SC)/S(=O)(=O)NC1=CC=CC=C1)/C)/C#N

InChI

InChI=1S/C19H23N3O4S2/c1-5-26-18(23)15(12-20)11-17(14(3)21)13(2)19(27-4)28(24,25)22-16-9-7-6-8-10-16/h6-11,22H,5,21H2,1-4H3/b15-11+,17-14+,19-13+