2-(3-phenylprop-2-ynylsulfanyl)-1H-benzimidazole

Systemtic Name: 2-(3-phenylprop-2-ynylsulfanyl)-1H-benzimidazole Openeye Name: 2-(3-phenylprop-2-ynylsulfanyl)-1H-benzimidazole CAS Name: 2-(3-phenylprop-2-ynylthio)-1H-benzimidazole IUPAC Name: 2-(3-phenylprop-2-ynylsulfanyl)-1H-benzimidazole Traditional Name: 2-(3-phenylprop-2-ynylthio)-1H-benzimidazole Formula: C16H12N2S MolecularWeight: 264.34488

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C#CCSC2=NC3=CC=CC=C3N2

Isomeric SMILES

C1=CC=C(C=C1)C#CCSC2=NC3=CC=CC=C3N2

InChI

InChI=1S/C16H12N2S/c1-2-7-13(8-3-1)9-6-12-19-16-17-14-10-4-5-11-15(14)18-16/h1-5,7-8,10-11H,12H2,(H,17,18)