N-[(2S)-1-(2-morpholin-4-ylethylamino)-3-oxidanyl-1-oxidanylidene-propan-2-yl]-3H-benzimidazole-5-carboxamide

Systemtic Name: N-[(2S)-1-(2-morpholin-4-ylethylamino)-3-oxidanyl-1-oxidanylidene-propan-2-yl]-3H-benzimidazole-5-carboxamide Openeye Name: N-[(1S)-1-(hydroxymethyl)-2-(2-morpholinoethylamino)-2-oxo-ethyl]-3H-benzimidazole-5-carboxamide CAS Name: N-[(2S)-3-hydroxy-1-[2-(4-morpholinyl)ethylamino]-1-oxopropan-2-yl]-3H-benzimidazole-5-carboxamide IUPAC Name: N-[(2S)-3-hydroxy-1-(2-morpholin-4-ylethylamino)-1-oxopropan-2-yl]-3H-benzimidazole-5-carboxamide Traditional Name: N-[(1S)-2-keto-1-methylol-2-(2-morpholinoethylamino)ethyl]-3H-benzimidazole-5-carboxamide Formula: C17H23N5O4 MolecularWeight: 361.39562

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCNC(=O)C(CO)NC(=O)C2=CC3=C(C=C2)N=CN3

Isomeric SMILES

C1COCCN1CCNC(=O)[C@H](CO)NC(=O)C2=CC3=C(C=C2)N=CN3

InChI

InChI=1S/C17H23N5O4/c23-10-15(17(25)18-3-4-22-5-7-26-8-6-22)21-16(24)12-1-2-13-14(9-12)20-11-19-13/h1-2,9,11,15,23H,3-8,10H2,(H,18,25)(H,19,20)(H,21,24)/t15-/m0/s1