2-adamantyl N-[3-(1H-indol-3-yl)-2-methyl-1-oxidanylidene-1-[(phenylmethyl)amino]propan-2-yl]carbamate

Systemtic Name: 2-adamantyl N-[3-(1H-indol-3-yl)-2-methyl-1-oxidanylidene-1-[(phenylmethyl)amino]propan-2-yl]carbamate Openeye Name: 2-adamantyl N-[2-(benzylamino)-1-(1H-indol-3-ylmethyl)-1-methyl-2-oxo-ethyl]carbamate CAS Name: N-[3-(1H-indol-3-yl)-2-methyl-1-oxo-1-[(phenylmethyl)amino]propan-2-yl]carbamic acid 2-adamantyl ester IUPAC Name: 2-adamantyl N-[1-(benzylamino)-3-(1H-indol-3-yl)-2-methyl-1-oxopropan-2-yl]carbamate Traditional Name: N-[2-(benzylamino)-1-(1H-indol-3-ylmethyl)-2-keto-1-methyl-ethyl]carbamic acid 2-adamantyl ester Formula: C30H35N3O3 MolecularWeight: 485.6172

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CNC2=CC=CC=C21)(C(=O)NCC3=CC=CC=C3)NC(=O)OC4C5CC6CC(C5)CC4C6

Isomeric SMILES

CC(CC1=CNC2=CC=CC=C21)(C(=O)NCC3=CC=CC=C3)NC(=O)OC4C5CC6CC(C5)CC4C6

InChI

InChI=1S/C30H35N3O3/c1-30(28(34)32-17-19-7-3-2-4-8-19,16-24-18-31-26-10-6-5-9-25(24)26)33-29(35)36-27-22-12-20-11-21(14-22)15-23(27)13-20/h2-10,18,20-23,27,31H,11-17H2,1H3,(H,32,34)(H,33,35)