5-[[(2S)-2-(2-morpholin-4-ylethylcarbamoylamino)-3-phenyl-propanoyl]amino]-N-oxidanyl-1-benzothiophene-2-carboxamide

Systemtic Name: 5-[[(2S)-2-(2-morpholin-4-ylethylcarbamoylamino)-3-phenyl-propanoyl]amino]-N-oxidanyl-1-benzothiophene-2-carboxamide Openeye Name: (2S)-N-[2-(hydroxycarbamoyl)benzothiophen-5-yl]-2-(2-morpholinoethylcarbamoylamino)-3-phenyl-propanamide CAS Name: N-hydroxy-5-[[(2S)-2-[[[2-(4-morpholinyl)ethylamino]-oxomethyl]amino]-1-oxo-3-phenylpropyl]amino]-1-benzothiophene-2-carboxamide IUPAC Name: N-hydroxy-5-[[(2S)-2-(2-morpholin-4-ylethylcarbamoylamino)-3-phenylpropanoyl]amino]-1-benzothiophene-2-carboxamide Traditional Name: (2S)-N-[2-(hydroxycarbamoyl)benzothiophen-5-yl]-2-(2-morpholinoethylcarbamoylamino)-3-phenyl-propionamide Formula: C25H29N5O5S MolecularWeight: 511.59326

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCNC(=O)NC(CC2=CC=CC=C2)C(=O)NC3=CC4=C(C=C3)SC(=C4)C(=O)NO

Isomeric SMILES

C1COCCN1CCNC(=O)N[C@@H](CC2=CC=CC=C2)C(=O)NC3=CC4=C(C=C3)SC(=C4)C(=O)NO

InChI

InChI=1S/C25H29N5O5S/c31-23(27-19-6-7-21-18(15-19)16-22(36-21)24(32)29-34)20(14-17-4-2-1-3-5-17)28-25(33)26-8-9-30-10-12-35-13-11-30/h1-7,15-16,20,34H,8-14H2,(H,27,31)(H,29,32)(H2,26,28,33)/t20-/m0/s1