tert-butyl 4-[[2-[(5-chloranylpyridin-2-yl)carbamoyl]-4-methylsulfonyl-phenyl]carbamoyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[[2-[(5-chloranylpyridin-2-yl)carbamoyl]-4-methylsulfonyl-phenyl]carbamoyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[[2-[(5-chloro-2-pyridyl)carbamoyl]-4-methylsulfonyl-phenyl]carbamoyl]piperidine-1-carboxylate CAS Name: 4-[[2-[[(5-chloro-2-pyridinyl)amino]-oxomethyl]-4-methylsulfonylanilino]-oxomethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[2-[(5-chloropyridin-2-yl)carbamoyl]-4-methylsulfonylphenyl]carbamoyl]piperidine-1-carboxylate Traditional Name: 4-[[2-[(5-chloro-2-pyridyl)carbamoyl]-4-mesyl-phenyl]carbamoyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C24H29ClN4O6S MolecularWeight: 537.02826

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)C(=O)NC2=C(C=C(C=C2)S(=O)(=O)C)C(=O)NC3=NC=C(C=C3)Cl

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)C(=O)NC2=C(C=C(C=C2)S(=O)(=O)C)C(=O)NC3=NC=C(C=C3)Cl

InChI

InChI=1S/C24H29ClN4O6S/c1-24(2,3)35-23(32)29-11-9-15(10-12-29)21(30)27-19-7-6-17(36(4,33)34)13-18(19)22(31)28-20-8-5-16(25)14-26-20/h5-8,13-15H,9-12H2,1-4H3,(H,27,30)(H,26,28,31)