N-(6-cyclohexylsulfanyl-1,3-dimethyl-2-oxidanylidene-benzimidazol-5-yl)-4-propoxy-benzamide

Systemtic Name: N-(6-cyclohexylsulfanyl-1,3-dimethyl-2-oxidanylidene-benzimidazol-5-yl)-4-propoxy-benzamide Openeye Name: N-(6-cyclohexylsulfanyl-1,3-dimethyl-2-oxo-benzimidazol-5-yl)-4-propoxy-benzamide CAS Name: N-[6-(cyclohexylthio)-1,3-dimethyl-2-oxo-5-benzimidazolyl]-4-propoxybenzamide IUPAC Name: N-(6-cyclohexylsulfanyl-1,3-dimethyl-2-oxobenzimidazol-5-yl)-4-propoxybenzamide Traditional Name: N-[6-(cyclohexylthio)-2-keto-1,3-dimethyl-benzimidazol-5-yl]-4-propoxy-benzamide Formula: C25H31N3O3S MolecularWeight: 453.59694

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(=O)NC2=C(C=C3C(=C2)N(C(=O)N3C)C)SC4CCCCC4

Isomeric SMILES

CCCOC1=CC=C(C=C1)C(=O)NC2=C(C=C3C(=C2)N(C(=O)N3C)C)SC4CCCCC4

InChI

InChI=1S/C25H31N3O3S/c1-4-14-31-18-12-10-17(11-13-18)24(29)26-20-15-21-22(28(3)25(30)27(21)2)16-23(20)32-19-8-6-5-7-9-19/h10-13,15-16,19H,4-9,14H2,1-3H3,(H,26,29)