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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(CC1CCCCC1)N(CC2=NC=CS2)C(=O)CCC(=O)N)O

Isomeric SMILES

CC(C)C[C@@H]([C@H](CC1CCCCC1)N(CC2=NC=CS2)C(=O)CCC(=O)N)O

InChI

InChI=1S/C21H35N3O3S/c1-15(2)12-18(25)17(13-16-6-4-3-5-7-16)24(14-20-23-10-11-28-20)21(27)9-8-19(22)26/h10-11,15-18,25H,3-9,12-14H2,1-2H3,(H2,22,26)/t17-,18-/m0/s1