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

Systemtic Name: N-[(2S)-1-[(3-methoxyphenyl)amino]-3-oxidanyl-1-oxidanylidene-propan-2-yl]-3H-benzimidazole-5-carboxamide Openeye Name: N-[(1S)-1-(hydroxymethyl)-2-(3-methoxyanilino)-2-oxo-ethyl]-3H-benzimidazole-5-carboxamide CAS Name: N-[(2S)-3-hydroxy-1-(3-methoxyanilino)-1-oxopropan-2-yl]-3H-benzimidazole-5-carboxamide IUPAC Name: N-[(2S)-3-hydroxy-1-(3-methoxyanilino)-1-oxopropan-2-yl]-3H-benzimidazole-5-carboxamide Traditional Name: N-[(1S)-2-keto-2-(m-anisidino)-1-methylol-ethyl]-3H-benzimidazole-5-carboxamide Formula: C18H18N4O4 MolecularWeight: 354.35992

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=O)C(CO)NC(=O)C2=CC3=C(C=C2)N=CN3

Isomeric SMILES

COC1=CC=CC(=C1)NC(=O)[C@H](CO)NC(=O)C2=CC3=C(C=C2)N=CN3

InChI

InChI=1S/C18H18N4O4/c1-26-13-4-2-3-12(8-13)21-18(25)16(9-23)22-17(24)11-5-6-14-15(7-11)20-10-19-14/h2-8,10,16,23H,9H2,1H3,(H,19,20)(H,21,25)(H,22,24)/t16-/m0/s1