1H-benzimidazol-2-ylmethyl 3-(4-chlorophenyl)sulfanylpropanoate

Systemtic Name: 1H-benzimidazol-2-ylmethyl 3-(4-chlorophenyl)sulfanylpropanoate Openeye Name: 1H-benzimidazol-2-ylmethyl 3-(4-chlorophenyl)sulfanylpropanoate CAS Name: 3-[(4-chlorophenyl)thio]propanoic acid 1H-benzimidazol-2-ylmethyl ester IUPAC Name: 1H-benzimidazol-2-ylmethyl 3-(4-chlorophenyl)sulfanylpropanoate Traditional Name: 3-[(4-chlorophenyl)thio]propionic acid 1H-benzimidazol-2-ylmethyl ester Formula: C17H15ClN2O2S MolecularWeight: 346.8312

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=N2)COC(=O)CCSC3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)COC(=O)CCSC3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H15ClN2O2S/c18-12-5-7-13(8-6-12)23-10-9-17(21)22-11-16-19-14-3-1-2-4-15(14)20-16/h1-8H,9-11H2,(H,19,20)