(2S)-N-(1-adamantylmethyl)-3-methyl-2-(2-phenylethanoylamino)butanamide

Systemtic Name: (2S)-N-(1-adamantylmethyl)-3-methyl-2-(2-phenylethanoylamino)butanamide Openeye Name: (2S)-N-(1-adamantylmethyl)-3-methyl-2-[(2-phenylacetyl)amino]butanamide CAS Name: (2S)-N-(1-adamantylmethyl)-3-methyl-2-[(1-oxo-2-phenylethyl)amino]butanamide IUPAC Name: (2S)-N-(1-adamantylmethyl)-3-methyl-2-[(2-phenylacetyl)amino]butanamide Traditional Name: (2S)-N-(1-adamantylmethyl)-3-methyl-2-[(2-phenylacetyl)amino]butyramide Formula: C24H34N2O2 MolecularWeight: 382.53896

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NCC12CC3CC(C1)CC(C3)C2)NC(=O)CC4=CC=CC=C4

Isomeric SMILES

CC(C)[C@@H](C(=O)NCC12CC3CC(C1)CC(C3)C2)NC(=O)CC4=CC=CC=C4

InChI

InChI=1S/C24H34N2O2/c1-16(2)22(26-21(27)11-17-6-4-3-5-7-17)23(28)25-15-24-12-18-8-19(13-24)10-20(9-18)14-24/h3-7,16,18-20,22H,8-15H2,1-2H3,(H,25,28)(H,26,27)/t18?,19?,20?,22-,24?/m0/s1