[(3E)-4-cyano-2,4-bis-(4-methylphenyl)sulfonyl-buta-1,3-dienylidene]azanide; triethylazanium

Systemtic Name: [(3E)-4-cyano-2,4-bis-(4-methylphenyl)sulfonyl-buta-1,3-dienylidene]azanide; triethylazanium Openeye Name: [(3E)-4-cyano-2,4-bis(p-tolylsulfonyl)buta-1,3-dienylidene]azanide; triethylammonium CAS Name: [(3E)-4-cyano-2,4-bis-(4-methylphenyl)sulfonylbuta-1,3-dienylidene]azanide; triethylammonium IUPAC Name: [(3E)-4-cyano-2,4-bis-(4-methylphenyl)sulfonylbuta-1,3-dienylidene]azanide; triethylazanium Traditional Name: [(3E)-4-cyano-2,4-ditosyl-buta-1,3-dienylidene]azanide; triethylammonium Formula: C25H31N3O4S2 MolecularWeight: 501.66134

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC.CC1=CC=C(C=C1)S(=O)(=O)C(=CC(=C=[N-])S(=O)(=O)C2=CC=C(C=C2)C)C#N

Isomeric SMILES

CC[NH+](CC)CC.CC1=CC=C(C=C1)S(=O)(=O)/C(=C/C(=C=[N-])S(=O)(=O)C2=CC=C(C=C2)C)/C#N

InChI

InChI=1S/C19H15N2O4S2.C6H15N/c1-14-3-7-16(8-4-14)26(22,23)18(12-20)11-19(13-21)27(24,25)17-9-5-15(2)6-10-17;1-4-7(5-2)6-3/h3-11H,1-2H3;4-6H2,1-3H3/q-1;/p+1/b18-11+;