2-[(3-methyl-4-prop-2-ynoxy-pyridin-2-yl)methylsulfanyl]-1H-benzimidazole

Systemtic Name: 2-[(3-methyl-4-prop-2-ynoxy-pyridin-2-yl)methylsulfanyl]-1H-benzimidazole Openeye Name: 2-[(3-methyl-4-prop-2-ynoxy-2-pyridyl)methylsulfanyl]-1H-benzimidazole CAS Name: 2-[(3-methyl-4-prop-2-ynoxy-2-pyridinyl)methylthio]-1H-benzimidazole IUPAC Name: 2-[(3-methyl-4-prop-2-ynoxypyridin-2-yl)methylsulfanyl]-1H-benzimidazole Traditional Name: 2-[(3-methyl-4-propargyloxy-2-pyridyl)methylthio]-1H-benzimidazole Formula: C17H15N3OS MolecularWeight: 309.3855

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CN=C1CSC2=NC3=CC=CC=C3N2)OCC#C

Isomeric SMILES

CC1=C(C=CN=C1CSC2=NC3=CC=CC=C3N2)OCC#C

InChI

InChI=1S/C17H15N3OS/c1-3-10-21-16-8-9-18-15(12(16)2)11-22-17-19-13-6-4-5-7-14(13)20-17/h1,4-9H,10-11H2,2H3,(H,19,20)