tert-butyl N-[(2S)-3-(1H-indol-3-yl)-1-oxidanylidene-1-(1,3-thiazol-2-ylmethylamino)propan-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2S)-3-(1H-indol-3-yl)-1-oxidanylidene-1-(1,3-thiazol-2-ylmethylamino)propan-2-yl]carbamate Openeye Name: tert-butyl N-[(1S)-1-(1H-indol-3-ylmethyl)-2-oxo-2-(thiazol-2-ylmethylamino)ethyl]carbamate CAS Name: N-[(2S)-3-(1H-indol-3-yl)-1-oxo-1-(2-thiazolylmethylamino)propan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2S)-3-(1H-indol-3-yl)-1-oxo-1-(1,3-thiazol-2-ylmethylamino)propan-2-yl]carbamate Traditional Name: N-[(1S)-1-(1H-indol-3-ylmethyl)-2-keto-2-(thiazol-2-ylmethylamino)ethyl]carbamic acid tert-butyl ester Formula: C20H24N4O3S MolecularWeight: 400.49456

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)NCC3=NC=CS3

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CC1=CNC2=CC=CC=C21)C(=O)NCC3=NC=CS3

InChI

InChI=1S/C20H24N4O3S/c1-20(2,3)27-19(26)24-16(18(25)23-12-17-21-8-9-28-17)10-13-11-22-15-7-5-4-6-14(13)15/h4-9,11,16,22H,10,12H2,1-3H3,(H,23,25)(H,24,26)/t16-/m0/s1