S-(1H-benzimidazol-2-yl) 2-phenylethanethioate

Systemtic Name: S-(1H-benzimidazol-2-yl) 2-phenylethanethioate Openeye Name: S-(1H-benzimidazol-2-yl) 2-phenylethanethioate CAS Name: 2-phenylethanethioic acid S-(1H-benzimidazol-2-yl) ester IUPAC Name: S-(1H-benzimidazol-2-yl) 2-phenylethanethioate Traditional Name: 2-phenylethanethioic acid S-(1H-benzimidazol-2-yl) ester Formula: C15H12N2OS MolecularWeight: 268.33358

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(=O)SC2=NC3=CC=CC=C3N2

Isomeric SMILES

C1=CC=C(C=C1)CC(=O)SC2=NC3=CC=CC=C3N2

InChI

InChI=1S/C15H12N2OS/c18-14(10-11-6-2-1-3-7-11)19-15-16-12-8-4-5-9-13(12)17-15/h1-9H,10H2,(H,16,17)