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

Systemtic Name: 5-[[(2S)-2-(2-methylpropanoylamino)-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-methyl-propanamide CAS Name: N-hydroxy-5-[[(2S)-2-[(2-methyl-1-oxopropyl)amino]-1-oxo-3-phenylpropyl]amino]-1-benzothiophene-2-carboxamide IUPAC Name: N-hydroxy-5-[[(2S)-2-(2-methylpropanoylamino)-3-phenylpropanoyl]amino]-1-benzothiophene-2-carboxamide Traditional Name: N-[(1S)-1-benzyl-2-[[2-(hydroxycarbamoyl)benzothiophen-5-yl]amino]-2-keto-ethyl]-2-methyl-propionamide Formula: C22H23N3O4S MolecularWeight: 425.50072

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC(CC1=CC=CC=C1)C(=O)NC2=CC3=C(C=C2)SC(=C3)C(=O)NO

Isomeric SMILES

CC(C)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NC2=CC3=C(C=C2)SC(=C3)C(=O)NO

InChI

InChI=1S/C22H23N3O4S/c1-13(2)20(26)24-17(10-14-6-4-3-5-7-14)21(27)23-16-8-9-18-15(11-16)12-19(30-18)22(28)25-29/h3-9,11-13,17,29H,10H2,1-2H3,(H,23,27)(H,24,26)(H,25,28)/t17-/m0/s1