N-(5,6-dimethyl-1H-benzimidazol-2-yl)-2-prop-2-enylsulfanyl-pyridine-3-carboxamide

Systemtic Name: N-(5,6-dimethyl-1H-benzimidazol-2-yl)-2-prop-2-enylsulfanyl-pyridine-3-carboxamide Openeye Name: 2-allylsulfanyl-N-(5,6-dimethyl-1H-benzimidazol-2-yl)pyridine-3-carboxamide CAS Name: N-(5,6-dimethyl-1H-benzimidazol-2-yl)-2-(prop-2-enylthio)-3-pyridinecarboxamide IUPAC Name: N-(5,6-dimethyl-1H-benzimidazol-2-yl)-2-prop-2-enylsulfanylpyridine-3-carboxamide Traditional Name: 2-(allylthio)-N-(5,6-dimethyl-1H-benzimidazol-2-yl)nicotinamide Formula: C18H18N4OS MolecularWeight: 338.42672

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)N=C(N2)NC(=O)C3=C(N=CC=C3)SCC=C

Isomeric SMILES

CC1=CC2=C(C=C1C)N=C(N2)NC(=O)C3=C(N=CC=C3)SCC=C

InChI

InChI=1S/C18H18N4OS/c1-4-8-24-17-13(6-5-7-19-17)16(23)22-18-20-14-9-11(2)12(3)10-15(14)21-18/h4-7,9-10H,1,8H2,2-3H3,(H2,20,21,22,23)