(4-methylphenyl)-(2-prop-2-ynylsulfanylbenzimidazol-1-yl)methanone

Systemtic Name: (4-methylphenyl)-(2-prop-2-ynylsulfanylbenzimidazol-1-yl)methanone Openeye Name: (2-prop-2-ynylsulfanylbenzimidazol-1-yl)-(p-tolyl)methanone CAS Name: (4-methylphenyl)-[2-(prop-2-ynylthio)-1-benzimidazolyl]methanone IUPAC Name: (4-methylphenyl)-(2-prop-2-ynylsulfanylbenzimidazol-1-yl)methanone Traditional Name: [2-(propargylthio)benzimidazol-1-yl]-(p-tolyl)methanone Formula: C18H14N2OS MolecularWeight: 306.38156

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2C3=CC=CC=C3N=C2SCC#C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2C3=CC=CC=C3N=C2SCC#C

InChI

InChI=1S/C18H14N2OS/c1-3-12-22-18-19-15-6-4-5-7-16(15)20(18)17(21)14-10-8-13(2)9-11-14/h1,4-11H,12H2,2H3