[3-(trifluoromethylsulfanyl)phenyl]methyl N-[1-azanyl-3-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]carbamate

Systemtic Name: [3-(trifluoromethylsulfanyl)phenyl]methyl N-[1-azanyl-3-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]carbamate Openeye Name: [3-(trifluoromethylsulfanyl)phenyl]methyl N-[2-amino-1-(1H-indol-3-ylmethyl)-2-oxo-ethyl]carbamate CAS Name: N-[1-amino-3-(1H-indol-3-yl)-1-oxopropan-2-yl]carbamic acid [3-(trifluoromethylthio)phenyl]methyl ester IUPAC Name: [3-(trifluoromethylsulfanyl)phenyl]methyl N-[1-amino-3-(1H-indol-3-yl)-1-oxopropan-2-yl]carbamate Traditional Name: N-[2-amino-1-(1H-indol-3-ylmethyl)-2-keto-ethyl]carbamic acid [3-(trifluoromethylthio)benzyl] ester Formula: C20H18F3N3O3S MolecularWeight: 437.43543

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)CC(C(=O)N)NC(=O)OCC3=CC(=CC=C3)SC(F)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)CC(C(=O)N)NC(=O)OCC3=CC(=CC=C3)SC(F)(F)F

InChI

InChI=1S/C20H18F3N3O3S/c21-20(22,23)30-14-5-3-4-12(8-14)11-29-19(28)26-17(18(24)27)9-13-10-25-16-7-2-1-6-15(13)16/h1-8,10,17,25H,9,11H2,(H2,24,27)(H,26,28)