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

Systemtic Name: N-[(2S)-1-(cyclohexylmethylamino)-3-oxidanyl-1-oxidanylidene-propan-2-yl]-3H-benzimidazole-5-carboxamide Openeye Name: N-[(1S)-2-(cyclohexylmethylamino)-1-(hydroxymethyl)-2-oxo-ethyl]-3H-benzimidazole-5-carboxamide CAS Name: N-[(2S)-1-(cyclohexylmethylamino)-3-hydroxy-1-oxopropan-2-yl]-3H-benzimidazole-5-carboxamide IUPAC Name: N-[(2S)-1-(cyclohexylmethylamino)-3-hydroxy-1-oxopropan-2-yl]-3H-benzimidazole-5-carboxamide Traditional Name: N-[(1S)-2-(cyclohexylmethylamino)-2-keto-1-methylol-ethyl]-3H-benzimidazole-5-carboxamide Formula: C18H24N4O3 MolecularWeight: 344.40816

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CNC(=O)C(CO)NC(=O)C2=CC3=C(C=C2)N=CN3

Isomeric SMILES

C1CCC(CC1)CNC(=O)[C@H](CO)NC(=O)C2=CC3=C(C=C2)N=CN3

InChI

InChI=1S/C18H24N4O3/c23-10-16(18(25)19-9-12-4-2-1-3-5-12)22-17(24)13-6-7-14-15(8-13)21-11-20-14/h6-8,11-12,16,23H,1-5,9-10H2,(H,19,25)(H,20,21)(H,22,24)/t16-/m0/s1