(1R)-1-cyclohexylethanamine; 6-methoxy-2-[(S)-(4-methoxy-3,5-dimethyl-pyridin-2-yl)methylsulfinyl]-1H-benzimidazole

Systemtic Name: (1R)-1-cyclohexylethanamine; 6-methoxy-2-[(S)-(4-methoxy-3,5-dimethyl-pyridin-2-yl)methylsulfinyl]-1H-benzimidazole Openeye Name: (1R)-1-cyclohexylethanamine; 6-methoxy-2-[(S)-(4-methoxy-3,5-dimethyl-2-pyridyl)methylsulfinyl]-1H-benzimidazole CAS Name: (1R)-1-cyclohexylethanamine; 6-methoxy-2-[(S)-(4-methoxy-3,5-dimethyl-2-pyridinyl)methylsulfinyl]-1H-benzimidazole IUPAC Name: (1R)-1-cyclohexylethanamine; 6-methoxy-2-[(S)-(4-methoxy-3,5-dimethylpyridin-2-yl)methylsulfinyl]-1H-benzimidazole Traditional Name: [(1R)-1-cyclohexylethyl]amine; 6-methoxy-2-[(S)-(4-methoxy-3,5-dimethyl-2-pyridyl)methylsulfinyl]-1H-benzimidazole Formula: C25H36N4O3S MolecularWeight: 472.64334

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C(=C1OC)C)CS(=O)C2=NC3=C(N2)C=C(C=C3)OC.CC(C1CCCCC1)N

Isomeric SMILES

CC1=CN=C(C(=C1OC)C)C[S@](=O)C2=NC3=C(N2)C=C(C=C3)OC.C[C@H](C1CCCCC1)N

InChI

InChI=1S/C17H19N3O3S.C8H17N/c1-10-8-18-15(11(2)16(10)23-4)9-24(21)17-19-13-6-5-12(22-3)7-14(13)20-17;1-7(9)8-5-3-2-4-6-8/h5-8H,9H2,1-4H3,(H,19,20);7-8H,2-6,9H2,1H3/t24-;7-/m01/s1