N-[(2S)-1-(3-bicyclo[2.2.1]heptanylamino)-3-oxidanyl-1-oxidanylidene-propan-2-yl]-3H-benzimidazole-5-carboxamide

Systemtic Name: N-[(2S)-1-(3-bicyclo[2.2.1]heptanylamino)-3-oxidanyl-1-oxidanylidene-propan-2-yl]-3H-benzimidazole-5-carboxamide Openeye Name: N-[(1S)-1-(hydroxymethyl)-2-(norbornan-2-ylamino)-2-oxo-ethyl]-3H-benzimidazole-5-carboxamide CAS Name: N-[(2S)-1-(3-bicyclo[2.2.1]heptanylamino)-3-hydroxy-1-oxopropan-2-yl]-3H-benzimidazole-5-carboxamide IUPAC Name: N-[(2S)-1-(3-bicyclo[2.2.1]heptanylamino)-3-hydroxy-1-oxopropan-2-yl]-3H-benzimidazole-5-carboxamide Traditional Name: N-[(1S)-2-keto-1-methylol-2-(2-norbornylamino)ethyl]-3H-benzimidazole-5-carboxamide Formula: C18H22N4O3 MolecularWeight: 342.39228

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2CC1CC2NC(=O)C(CO)NC(=O)C3=CC4=C(C=C3)N=CN4

Isomeric SMILES

C1CC2CC1CC2NC(=O)[C@H](CO)NC(=O)C3=CC4=C(C=C3)N=CN4

InChI

InChI=1S/C18H22N4O3/c23-8-16(18(25)21-14-6-10-1-2-11(14)5-10)22-17(24)12-3-4-13-15(7-12)20-9-19-13/h3-4,7,9-11,14,16,23H,1-2,5-6,8H2,(H,19,20)(H,21,25)(H,22,24)/t10?,11?,14?,16-/m0/s1