2-[2-(dicyanomethylidene)-3H-benzimidazol-1-yl]ethyl 4-methylbenzenesulfonate

Systemtic Name: 2-[2-(dicyanomethylidene)-3H-benzimidazol-1-yl]ethyl 4-methylbenzenesulfonate Openeye Name: 2-[2-(dicyanomethylene)-3H-benzimidazol-1-yl]ethyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 2-[2-(dicyanomethylidene)-3H-benzimidazol-1-yl]ethyl ester IUPAC Name: 2-[2-(dicyanomethylidene)-3H-benzimidazol-1-yl]ethyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 2-[2-(dicyanomethylene)-3H-benzimidazol-1-yl]ethyl ester Formula: C19H16N4O3S MolecularWeight: 380.42034

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCCN2C3=CC=CC=C3NC2=C(C#N)C#N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCCN2C3=CC=CC=C3NC2=C(C#N)C#N

InChI

InChI=1S/C19H16N4O3S/c1-14-6-8-16(9-7-14)27(24,25)26-11-10-23-18-5-3-2-4-17(18)22-19(23)15(12-20)13-21/h2-9,22H,10-11H2,1H3