5-[[(2S)-2-[(2,3-dimethoxyphenyl)carbonylamino]-3-phenyl-propanoyl]amino]-N-oxidanyl-1-benzothiophene-2-carboxamide

Systemtic Name: 5-[[(2S)-2-[(2,3-dimethoxyphenyl)carbonylamino]-3-phenyl-propanoyl]amino]-N-oxidanyl-1-benzothiophene-2-carboxamide Openeye Name: N-[(1S)-1-benzyl-2-[[2-(hydroxycarbamoyl)benzothiophen-5-yl]amino]-2-oxo-ethyl]-2,3-dimethoxy-benzamide CAS Name: 5-[[(2S)-2-[[(2,3-dimethoxyphenyl)-oxomethyl]amino]-1-oxo-3-phenylpropyl]amino]-N-hydroxy-1-benzothiophene-2-carboxamide IUPAC Name: 5-[[(2S)-2-[(2,3-dimethoxybenzoyl)amino]-3-phenylpropanoyl]amino]-N-hydroxy-1-benzothiophene-2-carboxamide Traditional Name: N-[(1S)-1-benzyl-2-[[2-(hydroxycarbamoyl)benzothiophen-5-yl]amino]-2-keto-ethyl]-2,3-dimethoxy-benzamide Formula: C27H25N3O6S MolecularWeight: 519.5689

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)C(=O)NC(CC2=CC=CC=C2)C(=O)NC3=CC4=C(C=C3)SC(=C4)C(=O)NO

Isomeric SMILES

COC1=CC=CC(=C1OC)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)NC3=CC4=C(C=C3)SC(=C4)C(=O)NO

InChI

InChI=1S/C27H25N3O6S/c1-35-21-10-6-9-19(24(21)36-2)25(31)29-20(13-16-7-4-3-5-8-16)26(32)28-18-11-12-22-17(14-18)15-23(37-22)27(33)30-34/h3-12,14-15,20,34H,13H2,1-2H3,(H,28,32)(H,29,31)(H,30,33)/t20-/m0/s1