N'-[(2S,3S)-1-cyclohexyl-5-methyl-3-oxidanyl-hexan-2-yl]-N'-(1,3-thiazol-4-ylmethyl)butanediamide

Systemtic Name: N'-[(2S,3S)-1-cyclohexyl-5-methyl-3-oxidanyl-hexan-2-yl]-N'-(1,3-thiazol-4-ylmethyl)butanediamide Openeye Name: N'-[(1S,2S)-1-(cyclohexylmethyl)-2-hydroxy-4-methyl-pentyl]-N'-(thiazol-4-ylmethyl)butanediamide CAS Name: N'-[(2S,3S)-1-cyclohexyl-3-hydroxy-5-methylhexan-2-yl]-N'-(4-thiazolylmethyl)butanediamide IUPAC Name: N'-[(2S,3S)-1-cyclohexyl-3-hydroxy-5-methylhexan-2-yl]-N'-(1,3-thiazol-4-ylmethyl)butanediamide Traditional Name: N'-[(1S,2S)-1-(cyclohexylmethyl)-2-hydroxy-4-methyl-pentyl]-N'-(thiazol-4-ylmethyl)succinamide Formula: C21H35N3O3S MolecularWeight: 409.5859

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(CC1CCCCC1)N(CC2=CSC=N2)C(=O)CCC(=O)N)O

Isomeric SMILES

CC(C)C[C@@H]([C@H](CC1CCCCC1)N(CC2=CSC=N2)C(=O)CCC(=O)N)O

InChI

InChI=1S/C21H35N3O3S/c1-15(2)10-19(25)18(11-16-6-4-3-5-7-16)24(12-17-13-28-14-23-17)21(27)9-8-20(22)26/h13-16,18-19,25H,3-12H2,1-2H3,(H2,22,26)/t18-,19-/m0/s1