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

Systemtic Name: 1-adamantyl N-[(2R)-3-(1H-indol-3-yl)-2-methyl-1-oxidanylidene-1-[(1-oxidanyl-3-phenyl-propan-2-yl)amino]propan-2-yl]carbamate Openeye Name: 1-adamantyl N-[(1R)-2-[(1-benzyl-2-hydroxy-ethyl)amino]-1-(1H-indol-3-ylmethyl)-1-methyl-2-oxo-ethyl]carbamate CAS Name: N-[(2R)-1-[(1-hydroxy-3-phenylpropan-2-yl)amino]-3-(1H-indol-3-yl)-2-methyl-1-oxopropan-2-yl]carbamic acid 1-adamantyl ester IUPAC Name: 1-adamantyl N-[(2R)-1-[(1-hydroxy-3-phenylpropan-2-yl)amino]-3-(1H-indol-3-yl)-2-methyl-1-oxopropan-2-yl]carbamate Traditional Name: N-[(1R)-2-[(1-benzyl-2-hydroxy-ethyl)amino]-1-(1H-indol-3-ylmethyl)-2-keto-1-methyl-ethyl]carbamic acid 1-adamantyl ester Formula: C32H39N3O4 MolecularWeight: 529.66976

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CNC2=CC=CC=C21)(C(=O)NC(CC3=CC=CC=C3)CO)NC(=O)OC45CC6CC(C4)CC(C6)C5

Isomeric SMILES

C[C@@](CC1=CNC2=CC=CC=C21)(C(=O)NC(CC3=CC=CC=C3)CO)NC(=O)OC45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C32H39N3O4/c1-31(18-25-19-33-28-10-6-5-9-27(25)28,29(37)34-26(20-36)14-21-7-3-2-4-8-21)35-30(38)39-32-15-22-11-23(16-32)13-24(12-22)17-32/h2-10,19,22-24,26,33,36H,11-18,20H2,1H3,(H,34,37)(H,35,38)/t22?,23?,24?,26?,31-,32?/m1/s1