(2S,4S)-N-(1H-benzimidazol-2-ylmethyl)-2-(4-oxidanylbutoxy)-4-thiophen-3-yl-3,4-dihydro-2H-pyran-6-carboxamide

Systemtic Name: (2S,4S)-N-(1H-benzimidazol-2-ylmethyl)-2-(4-oxidanylbutoxy)-4-thiophen-3-yl-3,4-dihydro-2H-pyran-6-carboxamide Openeye Name: (2S,4S)-N-(1H-benzimidazol-2-ylmethyl)-2-(4-hydroxybutoxy)-4-(3-thienyl)-3,4-dihydro-2H-pyran-6-carboxamide CAS Name: (2S,4S)-N-(1H-benzimidazol-2-ylmethyl)-2-(4-hydroxybutoxy)-4-(3-thiophenyl)-3,4-dihydro-2H-pyran-6-carboxamide IUPAC Name: (2S,4S)-N-(1H-benzimidazol-2-ylmethyl)-2-(4-hydroxybutoxy)-4-thiophen-3-yl-3,4-dihydro-2H-pyran-6-carboxamide Traditional Name: (2S,4S)-N-(1H-benzimidazol-2-ylmethyl)-2-(4-hydroxybutoxy)-4-(3-thienyl)-3,4-dihydro-2H-pyran-6-carboxamide Formula: C22H25N3O4S MolecularWeight: 427.5166

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C=C(OC1OCCCCO)C(=O)NCC2=NC3=CC=CC=C3N2)C4=CSC=C4

Isomeric SMILES

C1[C@@H](C=C(O[C@@H]1OCCCCO)C(=O)NCC2=NC3=CC=CC=C3N2)C4=CSC=C4

InChI

InChI=1S/C22H25N3O4S/c26-8-3-4-9-28-21-12-16(15-7-10-30-14-15)11-19(29-21)22(27)23-13-20-24-17-5-1-2-6-18(17)25-20/h1-2,5-7,10-11,14,16,21,26H,3-4,8-9,12-13H2,(H,23,27)(H,24,25)/t16-,21+/m1/s1