(2S,3R,4R)-N-(1H-benzimidazol-2-ylmethyl)-4-cyclohexyl-2-ethoxy-3-(3-oxidanylpropyl)-3,4-dihydro-2H-pyran-6-carboxamide

Systemtic Name: (2S,3R,4R)-N-(1H-benzimidazol-2-ylmethyl)-4-cyclohexyl-2-ethoxy-3-(3-oxidanylpropyl)-3,4-dihydro-2H-pyran-6-carboxamide Openeye Name: (2S,3R,4R)-N-(1H-benzimidazol-2-ylmethyl)-4-cyclohexyl-2-ethoxy-3-(3-hydroxypropyl)-3,4-dihydro-2H-pyran-6-carboxamide CAS Name: (2S,3R,4R)-N-(1H-benzimidazol-2-ylmethyl)-4-cyclohexyl-2-ethoxy-3-(3-hydroxypropyl)-3,4-dihydro-2H-pyran-6-carboxamide IUPAC Name: (2S,3R,4R)-N-(1H-benzimidazol-2-ylmethyl)-4-cyclohexyl-2-ethoxy-3-(3-hydroxypropyl)-3,4-dihydro-2H-pyran-6-carboxamide Traditional Name: (2S,3R,4R)-N-(1H-benzimidazol-2-ylmethyl)-4-cyclohexyl-2-ethoxy-3-(3-hydroxypropyl)-3,4-dihydro-2H-pyran-6-carboxamide Formula: C25H35N3O4 MolecularWeight: 441.5631

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1C(C(C=C(O1)C(=O)NCC2=NC3=CC=CC=C3N2)C4CCCCC4)CCCO

Isomeric SMILES

CCO[C@@H]1[C@@H]([C@@H](C=C(O1)C(=O)NCC2=NC3=CC=CC=C3N2)C4CCCCC4)CCCO

InChI

InChI=1S/C25H35N3O4/c1-2-31-25-18(11-8-14-29)19(17-9-4-3-5-10-17)15-22(32-25)24(30)26-16-23-27-20-12-6-7-13-21(20)28-23/h6-7,12-13,15,17-19,25,29H,2-5,8-11,14,16H2,1H3,(H,26,30)(H,27,28)/t18-,19+,25+/m1/s1