(2S)-N-(1-adamantylmethyl)-4-methylsulfanyl-2-(2-phenoxyethanoylamino)butanamide

Systemtic Name: (2S)-N-(1-adamantylmethyl)-4-methylsulfanyl-2-(2-phenoxyethanoylamino)butanamide Openeye Name: (2S)-N-(1-adamantylmethyl)-4-methylsulfanyl-2-[(2-phenoxyacetyl)amino]butanamide CAS Name: (2S)-N-(1-adamantylmethyl)-4-(methylthio)-2-[(1-oxo-2-phenoxyethyl)amino]butanamide IUPAC Name: (2S)-N-(1-adamantylmethyl)-4-methylsulfanyl-2-[(2-phenoxyacetyl)amino]butanamide Traditional Name: (2S)-N-(1-adamantylmethyl)-4-(methylthio)-2-[(2-phenoxyacetyl)amino]butyramide Formula: C24H34N2O3S MolecularWeight: 430.60336

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NCC12CC3CC(C1)CC(C3)C2)NC(=O)COC4=CC=CC=C4

Isomeric SMILES

CSCC[C@@H](C(=O)NCC12CC3CC(C1)CC(C3)C2)NC(=O)COC4=CC=CC=C4

InChI

InChI=1S/C24H34N2O3S/c1-30-8-7-21(26-22(27)15-29-20-5-3-2-4-6-20)23(28)25-16-24-12-17-9-18(13-24)11-19(10-17)14-24/h2-6,17-19,21H,7-16H2,1H3,(H,25,28)(H,26,27)/t17?,18?,19?,21-,24?/m0/s1