2-adamantyl N-[(2R)-4-(cyclohexylamino)-1-(1H-indol-3-yl)-2-methyl-3-oxidanylidene-butan-2-yl]carbamate

Systemtic Name: 2-adamantyl N-[(2R)-4-(cyclohexylamino)-1-(1H-indol-3-yl)-2-methyl-3-oxidanylidene-butan-2-yl]carbamate Openeye Name: 2-adamantyl N-[(1R)-3-(cyclohexylamino)-1-(1H-indol-3-ylmethyl)-1-methyl-2-oxo-propyl]carbamate CAS Name: N-[(2R)-4-(cyclohexylamino)-1-(1H-indol-3-yl)-2-methyl-3-oxobutan-2-yl]carbamic acid 2-adamantyl ester IUPAC Name: 2-adamantyl N-[(2R)-4-(cyclohexylamino)-1-(1H-indol-3-yl)-2-methyl-3-oxobutan-2-yl]carbamate Traditional Name: N-[(1R)-3-(cyclohexylamino)-1-(1H-indol-3-ylmethyl)-2-keto-1-methyl-propyl]carbamic acid 2-adamantyl ester Formula: C30H41N3O3 MolecularWeight: 491.66484

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CNC2=CC=CC=C21)(C(=O)CNC3CCCCC3)NC(=O)OC4C5CC6CC(C5)CC4C6

Isomeric SMILES

C[C@@](CC1=CNC2=CC=CC=C21)(C(=O)CNC3CCCCC3)NC(=O)OC4C5CC6CC(C5)CC4C6

InChI

InChI=1S/C30H41N3O3/c1-30(27(34)18-31-24-7-3-2-4-8-24,16-23-17-32-26-10-6-5-9-25(23)26)33-29(35)36-28-21-12-19-11-20(14-21)15-22(28)13-19/h5-6,9-10,17,19-22,24,28,31-32H,2-4,7-8,11-16,18H2,1H3,(H,33,35)/t19?,20?,21?,22?,28?,30-/m1/s1