3-[[1-(tert-butylamino)-4-methyl-1-oxidanylidene-pentan-2-yl]amino]-2-oxidanyl-2-(1-phenylbutan-2-yl)thiane-3-carboxamide

Systemtic Name: 3-[[1-(tert-butylamino)-4-methyl-1-oxidanylidene-pentan-2-yl]amino]-2-oxidanyl-2-(1-phenylbutan-2-yl)thiane-3-carboxamide Openeye Name: 2-(1-benzylpropyl)-3-[[1-(tert-butylcarbamoyl)-3-methyl-butyl]amino]-2-hydroxy-tetrahydrothiopyran-3-carboxamide CAS Name: 3-[[1-(tert-butylamino)-4-methyl-1-oxopentan-2-yl]amino]-2-hydroxy-2-(1-phenylbutan-2-yl)-3-thianecarboxamide IUPAC Name: 3-[[1-(tert-butylamino)-4-methyl-1-oxopentan-2-yl]amino]-2-hydroxy-2-(1-phenylbutan-2-yl)thiane-3-carboxamide Traditional Name: 2-(1-benzylpropyl)-3-[[1-(tert-butylcarbamoyl)-3-methyl-butyl]amino]-2-hydroxy-tetrahydrothiopyran-3-carboxamide Formula: C26H43N3O3S MolecularWeight: 477.70292

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC1=CC=CC=C1)C2(C(CCCS2)(C(=O)N)NC(CC(C)C)C(=O)NC(C)(C)C)O

Isomeric SMILES

CCC(CC1=CC=CC=C1)C2(C(CCCS2)(C(=O)N)NC(CC(C)C)C(=O)NC(C)(C)C)O

InChI

InChI=1S/C26H43N3O3S/c1-7-20(17-19-12-9-8-10-13-19)26(32)25(23(27)31,14-11-15-33-26)28-21(16-18(2)3)22(30)29-24(4,5)6/h8-10,12-13,18,20-21,28,32H,7,11,14-17H2,1-6H3,(H2,27,31)(H,29,30)