tert-butyl 4-[(5-chloranyl-1H-indol-2-yl)sulfonyl]-2-[2-(methylsulfonylamino)-2-oxidanylidene-ethyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[(5-chloranyl-1H-indol-2-yl)sulfonyl]-2-[2-(methylsulfonylamino)-2-oxidanylidene-ethyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[(5-chloro-1H-indol-2-yl)sulfonyl]-2-[2-(methanesulfonamido)-2-oxo-ethyl]piperazine-1-carboxylate CAS Name: 4-[(5-chloro-1H-indol-2-yl)sulfonyl]-2-[2-(methanesulfonamido)-2-oxoethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(5-chloro-1H-indol-2-yl)sulfonyl]-2-[2-(methanesulfonamido)-2-oxoethyl]piperazine-1-carboxylate Traditional Name: 4-[(5-chloro-1H-indol-2-yl)sulfonyl]-2-[2-keto-2-(methanesulfonamido)ethyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C20H27ClN4O7S2 MolecularWeight: 535.03398

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1CC(=O)NS(=O)(=O)C)S(=O)(=O)C2=CC3=C(N2)C=CC(=C3)Cl

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1CC(=O)NS(=O)(=O)C)S(=O)(=O)C2=CC3=C(N2)C=CC(=C3)Cl

InChI

InChI=1S/C20H27ClN4O7S2/c1-20(2,3)32-19(27)25-8-7-24(12-15(25)11-17(26)23-33(4,28)29)34(30,31)18-10-13-9-14(21)5-6-16(13)22-18/h5-6,9-10,15,22H,7-8,11-12H2,1-4H3,(H,23,26)