(4-cyanophenyl)methyl 2-(1-propylbenzimidazol-2-yl)sulfanylethanoate

Systemtic Name: (4-cyanophenyl)methyl 2-(1-propylbenzimidazol-2-yl)sulfanylethanoate Openeye Name: (4-cyanophenyl)methyl 2-(1-propylbenzimidazol-2-yl)sulfanylacetate CAS Name: 2-[(1-propyl-2-benzimidazolyl)thio]acetic acid (4-cyanophenyl)methyl ester IUPAC Name: (4-cyanophenyl)methyl 2-(1-propylbenzimidazol-2-yl)sulfanylacetate Traditional Name: 2-[(1-propylbenzimidazol-2-yl)thio]acetic acid (4-cyanobenzyl) ester Formula: C20H19N3O2S MolecularWeight: 365.44876

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=CC=CC=C2N=C1SCC(=O)OCC3=CC=C(C=C3)C#N

Isomeric SMILES

CCCN1C2=CC=CC=C2N=C1SCC(=O)OCC3=CC=C(C=C3)C#N

InChI

InChI=1S/C20H19N3O2S/c1-2-11-23-18-6-4-3-5-17(18)22-20(23)26-14-19(24)25-13-16-9-7-15(12-21)8-10-16/h3-10H,2,11,13-14H2,1H3