phenyl-(2-prop-2-ynylsulfanyl-3H-benzimidazol-5-yl)methanone

Systemtic Name: phenyl-(2-prop-2-ynylsulfanyl-3H-benzimidazol-5-yl)methanone Openeye Name: phenyl-(2-prop-2-ynylsulfanyl-3H-benzimidazol-5-yl)methanone CAS Name: phenyl-[2-(prop-2-ynylthio)-3H-benzimidazol-5-yl]methanone IUPAC Name: phenyl-(2-prop-2-ynylsulfanyl-3H-benzimidazol-5-yl)methanone Traditional Name: phenyl-[2-(propargylthio)-3H-benzimidazol-5-yl]methanone Formula: C17H12N2OS MolecularWeight: 292.35498

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Descriptors Computed from Structure

Canonical SMILES:

C#CCSC1=NC2=C(N1)C=C(C=C2)C(=O)C3=CC=CC=C3

Isomeric SMILES

C#CCSC1=NC2=C(N1)C=C(C=C2)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C17H12N2OS/c1-2-10-21-17-18-14-9-8-13(11-15(14)19-17)16(20)12-6-4-3-5-7-12/h1,3-9,11H,10H2,(H,18,19)