2-(1-adamantylsulfanyl)-N-[(2S)-3-oxidanylidene-1-phenyl-butan-2-yl]ethanamide

Systemtic Name: 2-(1-adamantylsulfanyl)-N-[(2S)-3-oxidanylidene-1-phenyl-butan-2-yl]ethanamide Openeye Name: 2-(1-adamantylsulfanyl)-N-[(1S)-1-benzyl-2-oxo-propyl]acetamide CAS Name: 2-(1-adamantylthio)-N-[(2S)-3-oxo-1-phenylbutan-2-yl]acetamide IUPAC Name: 2-(1-adamantylsulfanyl)-N-[(2S)-3-oxo-1-phenylbutan-2-yl]acetamide Traditional Name: 2-(1-adamantylthio)-N-[(1S)-1-benzyl-2-keto-propyl]acetamide Formula: C22H29NO2S MolecularWeight: 371.53616

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(CC1=CC=CC=C1)NC(=O)CSC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC(=O)[C@H](CC1=CC=CC=C1)NC(=O)CSC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C22H29NO2S/c1-15(24)20(10-16-5-3-2-4-6-16)23-21(25)14-26-22-11-17-7-18(12-22)9-19(8-17)13-22/h2-6,17-20H,7-14H2,1H3,(H,23,25)/t17?,18?,19?,20-,22?/m0/s1