N-[(2R)-1-(1-adamantylmethylamino)-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]benzamide

Systemtic Name: N-[(2R)-1-(1-adamantylmethylamino)-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]benzamide Openeye Name: N-[(1R)-1-(1-adamantylmethylcarbamoyl)-3-methylsulfanyl-propyl]benzamide CAS Name: N-[(2R)-1-(1-adamantylmethylamino)-4-(methylthio)-1-oxobutan-2-yl]benzamide IUPAC Name: N-[(2R)-1-(1-adamantylmethylamino)-4-methylsulfanyl-1-oxobutan-2-yl]benzamide Traditional Name: N-[(1R)-1-(1-adamantylmethylcarbamoyl)-3-(methylthio)propyl]benzamide Formula: C23H32N2O2S MolecularWeight: 400.57738

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H32N2O2S/c1-28-8-7-20(25-21(26)19-5-3-2-4-6-19)22(27)24-15-23-12-16-9-17(13-23)11-18(10-16)14-23/h2-6,16-18,20H,7-15H2,1H3,(H,24,27)(H,25,26)/t16?,17?,18?,20-,23?/m1/s1