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

Systemtic Name: N-[(2S)-1-(dipropylamino)-3-oxidanyl-1-oxidanylidene-propan-2-yl]-3H-benzimidazole-5-carboxamide Openeye Name: N-[(1S)-2-(dipropylamino)-1-(hydroxymethyl)-2-oxo-ethyl]-3H-benzimidazole-5-carboxamide CAS Name: N-[(2S)-1-(dipropylamino)-3-hydroxy-1-oxopropan-2-yl]-3H-benzimidazole-5-carboxamide IUPAC Name: N-[(2S)-1-(dipropylamino)-3-hydroxy-1-oxopropan-2-yl]-3H-benzimidazole-5-carboxamide Traditional Name: N-[(1S)-2-(dipropylamino)-2-keto-1-methylol-ethyl]-3H-benzimidazole-5-carboxamide Formula: C17H24N4O3 MolecularWeight: 332.39746

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)C(=O)C(CO)NC(=O)C1=CC2=C(C=C1)N=CN2

Isomeric SMILES

CCCN(CCC)C(=O)[C@H](CO)NC(=O)C1=CC2=C(C=C1)N=CN2

InChI

InChI=1S/C17H24N4O3/c1-3-7-21(8-4-2)17(24)15(10-22)20-16(23)12-5-6-13-14(9-12)19-11-18-13/h5-6,9,11,15,22H,3-4,7-8,10H2,1-2H3,(H,18,19)(H,20,23)/t15-/m0/s1