2-adamantyl N-[(2R)-3-(1H-indol-3-yl)-2-methyl-1-oxidanylidene-1-(pyrrolidin-1-ylamino)propan-2-yl]carbamate

Systemtic Name: 2-adamantyl N-[(2R)-3-(1H-indol-3-yl)-2-methyl-1-oxidanylidene-1-(pyrrolidin-1-ylamino)propan-2-yl]carbamate Openeye Name: 2-adamantyl N-[(1R)-1-(1H-indol-3-ylmethyl)-1-methyl-2-oxo-2-(pyrrolidin-1-ylamino)ethyl]carbamate CAS Name: N-[(2R)-3-(1H-indol-3-yl)-2-methyl-1-oxo-1-(1-pyrrolidinylamino)propan-2-yl]carbamic acid 2-adamantyl ester IUPAC Name: 2-adamantyl N-[(2R)-3-(1H-indol-3-yl)-2-methyl-1-oxo-1-(pyrrolidin-1-ylamino)propan-2-yl]carbamate Traditional Name: N-[(1R)-1-(1H-indol-3-ylmethyl)-2-keto-1-methyl-2-(pyrrolidinoamino)ethyl]carbamic acid 2-adamantyl ester Formula: C27H36N4O3 MolecularWeight: 464.59974

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CNC2=CC=CC=C21)(C(=O)NN3CCCC3)NC(=O)OC4C5CC6CC(C5)CC4C6

Isomeric SMILES

C[C@@](CC1=CNC2=CC=CC=C21)(C(=O)NN3CCCC3)NC(=O)OC4C5CC6CC(C5)CC4C6

InChI

InChI=1S/C27H36N4O3/c1-27(25(32)30-31-8-4-5-9-31,15-21-16-28-23-7-3-2-6-22(21)23)29-26(33)34-24-19-11-17-10-18(13-19)14-20(24)12-17/h2-3,6-7,16-20,24,28H,4-5,8-15H2,1H3,(H,29,33)(H,30,32)/t17?,18?,19?,20?,24?,27-/m1/s1