[(E)-[cyano-(4-methanethioylphenyl)methylidene]amino] 4-methylbenzenesulfonate

Systemtic Name: [(E)-[cyano-(4-methanethioylphenyl)methylidene]amino] 4-methylbenzenesulfonate Openeye Name: [(E)-[cyano-(4-methanethioylphenyl)methylene]amino] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(E)-[cyano-(4-methanethioylphenyl)methylidene]amino] ester IUPAC Name: [(E)-[cyano-(4-methanethioylphenyl)methylidene]amino] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(E)-[cyano-(4-thioformylphenyl)methylene]amino] ester Formula: C16H12N2O3S2 MolecularWeight: 344.40808

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)ON=C(C#N)C2=CC=C(C=C2)C=S

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O/N=C(/C#N)\C2=CC=C(C=C2)C=S

InChI

InChI=1S/C16H12N2O3S2/c1-12-2-8-15(9-3-12)23(19,20)21-18-16(10-17)14-6-4-13(11-22)5-7-14/h2-9,11H,1H3/b18-16-