4-but-2-ynoxy-6-[2-(2-dimethylaminoethylamino)-2-oxidanylidene-ethyl]-2,2-dimethyl-N-oxidanyl-3-phenyl-5-sulfonyl-thiomorpholine-3-carboxamide

Systemtic Name: 4-but-2-ynoxy-6-[2-(2-dimethylaminoethylamino)-2-oxidanylidene-ethyl]-2,2-dimethyl-N-oxidanyl-3-phenyl-5-sulfonyl-thiomorpholine-3-carboxamide Openeye Name: 2-[4-but-2-ynoxy-5-(hydroxycarbamoyl)-6,6-dimethyl-5-phenyl-3-sulfonyl-thiomorpholin-2-yl]-N-(2-dimethylaminoethyl)acetamide CAS Name: 4-but-2-ynoxy-6-[2-(2-dimethylaminoethylamino)-2-oxoethyl]-N-hydroxy-2,2-dimethyl-3-phenyl-5-sulfonyl-3-thiomorpholinecarboxamide IUPAC Name: 4-but-2-ynoxy-6-[2-(2-dimethylaminoethylamino)-2-oxoethyl]-N-hydroxy-2,2-dimethyl-3-phenyl-5-sulfonylthiomorpholine-3-carboxamide Traditional Name: 2-[4-but-2-ynoxy-5-(hydroxycarbamoyl)-6,6-dimethyl-5-phenyl-3-sulfonyl-thiomorpholin-2-yl]-N-(2-dimethylaminoethyl)acetamide Formula: C23H32N4O6S2 MolecularWeight: 524.65338

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC#CCON1C(=S(=O)=O)C(SC(C1(C2=CC=CC=C2)C(=O)NO)(C)C)CC(=O)NCCN(C)C

Isomeric SMILES

CC#CCON1C(=S(=O)=O)C(SC(C1(C2=CC=CC=C2)C(=O)NO)(C)C)CC(=O)NCCN(C)C

InChI

InChI=1S/C23H32N4O6S2/c1-6-7-15-33-27-20(35(31)32)18(16-19(28)24-13-14-26(4)5)34-22(2,3)23(27,21(29)25-30)17-11-9-8-10-12-17/h8-12,18,30H,13-16H2,1-5H3,(H,24,28)(H,25,29)