(2S)-2-(1-adamantylsulfanyl)-N-aminocarbonyl-3-methyl-butanamide

Systemtic Name: (2S)-2-(1-adamantylsulfanyl)-N-aminocarbonyl-3-methyl-butanamide Openeye Name: (2S)-2-(1-adamantylsulfanyl)-N-carbamoyl-3-methyl-butanamide CAS Name: (2S)-2-(1-adamantylthio)-N-carbamoyl-3-methylbutanamide IUPAC Name: (2S)-2-(1-adamantylsulfanyl)-N-carbamoyl-3-methylbutanamide Traditional Name: (2S)-2-(1-adamantylthio)-N-carbamoyl-3-methyl-butyramide Formula: C16H26N2O2S MolecularWeight: 310.45484

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC(=O)N)SC12CC3CC(C1)CC(C3)C2

Isomeric SMILES

CC(C)[C@@H](C(=O)NC(=O)N)SC12CC3CC(C1)CC(C3)C2

InChI

InChI=1S/C16H26N2O2S/c1-9(2)13(14(19)18-15(17)20)21-16-6-10-3-11(7-16)5-12(4-10)8-16/h9-13H,3-8H2,1-2H3,(H3,17,18,19,20)/t10?,11?,12?,13-,16?/m0/s1