tert-butyl 4-[[2-[(5-chloranylpyridin-2-yl)carbamoyl]pyridin-3-yl]carbamoyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[[2-[(5-chloranylpyridin-2-yl)carbamoyl]pyridin-3-yl]carbamoyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[[2-[(5-chloro-2-pyridyl)carbamoyl]-3-pyridyl]carbamoyl]piperidine-1-carboxylate CAS Name: 4-[[[2-[[(5-chloro-2-pyridinyl)amino]-oxomethyl]-3-pyridinyl]amino]-oxomethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[2-[(5-chloropyridin-2-yl)carbamoyl]pyridin-3-yl]carbamoyl]piperidine-1-carboxylate Traditional Name: 4-[[2-[(5-chloro-2-pyridyl)carbamoyl]-3-pyridyl]carbamoyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C22H26ClN5O4 MolecularWeight: 459.92594

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H26ClN5O4/c1-22(2,3)32-21(31)28-11-8-14(9-12-28)19(29)26-16-5-4-10-24-18(16)20(30)27-17-7-6-15(23)13-25-17/h4-7,10,13-14H,8-9,11-12H2,1-3H3,(H,26,29)(H,25,27,30)