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

Systemtic Name: N-oxidanyl-5-[[(2S)-3-phenyl-2-(3-phenylpropylcarbamoylamino)propanoyl]amino]-1-benzothiophene-2-carboxamide Openeye Name: (2S)-N-[2-(hydroxycarbamoyl)benzothiophen-5-yl]-3-phenyl-2-(3-phenylpropylcarbamoylamino)propanamide CAS Name: N-hydroxy-5-[[(2S)-1-oxo-2-[[oxo-(3-phenylpropylamino)methyl]amino]-3-phenylpropyl]amino]-1-benzothiophene-2-carboxamide IUPAC Name: N-hydroxy-5-[[(2S)-3-phenyl-2-(3-phenylpropylcarbamoylamino)propanoyl]amino]-1-benzothiophene-2-carboxamide Traditional Name: (2S)-N-[2-(hydroxycarbamoyl)benzothiophen-5-yl]-3-phenyl-2-(3-phenylpropylcarbamoylamino)propionamide Formula: C28H28N4O4S MolecularWeight: 516.61132

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C28H28N4O4S/c33-26(30-22-13-14-24-21(17-22)18-25(37-24)27(34)32-36)23(16-20-10-5-2-6-11-20)31-28(35)29-15-7-12-19-8-3-1-4-9-19/h1-6,8-11,13-14,17-18,23,36H,7,12,15-16H2,(H,30,33)(H,32,34)(H2,29,31,35)/t23-/m0/s1