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

Systemtic Name: N-oxidanyl-5-[[(2S)-2-(phenethylcarbamoylamino)-3-phenyl-propanoyl]amino]-1-benzothiophene-2-carboxamide Openeye Name: (2S)-N-[2-(hydroxycarbamoyl)benzothiophen-5-yl]-2-(phenethylcarbamoylamino)-3-phenyl-propanamide CAS Name: N-hydroxy-5-[[(2S)-1-oxo-2-[[oxo-(phenethylamino)methyl]amino]-3-phenylpropyl]amino]-1-benzothiophene-2-carboxamide IUPAC Name: N-hydroxy-5-[[(2S)-2-(phenethylcarbamoylamino)-3-phenylpropanoyl]amino]-1-benzothiophene-2-carboxamide Traditional Name: (2S)-N-[2-(hydroxycarbamoyl)benzothiophen-5-yl]-2-(phenethylcarbamoylamino)-3-phenyl-propionamide Formula: C27H26N4O4S MolecularWeight: 502.58474

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=O)NC(CC2=CC=CC=C2)C(=O)NC3=CC4=C(C=C3)SC(=C4)C(=O)NO

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=O)N[C@@H](CC2=CC=CC=C2)C(=O)NC3=CC4=C(C=C3)SC(=C4)C(=O)NO

InChI

InChI=1S/C27H26N4O4S/c32-25(29-21-11-12-23-20(16-21)17-24(36-23)26(33)31-35)22(15-19-9-5-2-6-10-19)30-27(34)28-14-13-18-7-3-1-4-8-18/h1-12,16-17,22,35H,13-15H2,(H,29,32)(H,31,33)(H2,28,30,34)/t22-/m0/s1