2-[(E)-2-(4-methylsulfanylphenyl)ethenyl]-1H-benzimidazole-4-carboxylate

Systemtic Name: 2-[(E)-2-(4-methylsulfanylphenyl)ethenyl]-1H-benzimidazole-4-carboxylate Openeye Name: 2-[(E)-2-(4-methylsulfanylphenyl)vinyl]-1H-benzimidazole-4-carboxylate CAS Name: 2-[(E)-2-[4-(methylthio)phenyl]ethenyl]-1H-benzimidazole-4-carboxylate IUPAC Name: 2-[(E)-2-(4-methylsulfanylphenyl)ethenyl]-1H-benzimidazole-4-carboxylate Traditional Name: 2-[(E)-2-[4-(methylthio)phenyl]vinyl]-1H-benzimidazole-4-carboxylate Formula: C17H13N2O2S- MolecularWeight: 309.36232

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C=CC2=NC3=C(C=CC=C3N2)C(=O)[O-]

Isomeric SMILES

CSC1=CC=C(C=C1)/C=C/C2=NC3=C(C=CC=C3N2)C(=O)[O-]

InChI

InChI=1S/C17H14N2O2S/c1-22-12-8-5-11(6-9-12)7-10-15-18-14-4-2-3-13(17(20)21)16(14)19-15/h2-10H,1H3,(H,18,19)(H,20,21)/p-1/b10-7+