4-tert-butyl-N-[2-[(5-chloranylpyridin-2-yl)carbamoyl]phenyl]piperazine-1-carboxamide

Systemtic Name: 4-tert-butyl-N-[2-[(5-chloranylpyridin-2-yl)carbamoyl]phenyl]piperazine-1-carboxamide Openeye Name: 4-tert-butyl-N-[2-[(5-chloro-2-pyridyl)carbamoyl]phenyl]piperazine-1-carboxamide CAS Name: 4-tert-butyl-N-[2-[[(5-chloro-2-pyridinyl)amino]-oxomethyl]phenyl]-1-piperazinecarboxamide IUPAC Name: 4-tert-butyl-N-[2-[(5-chloropyridin-2-yl)carbamoyl]phenyl]piperazine-1-carboxamide Traditional Name: 4-tert-butyl-N-[2-[(5-chloro-2-pyridyl)carbamoyl]phenyl]piperazine-1-carboxamide Formula: C21H26ClN5O2 MolecularWeight: 415.91644

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1CCN(CC1)C(=O)NC2=CC=CC=C2C(=O)NC3=NC=C(C=C3)Cl

Isomeric SMILES

CC(C)(C)N1CCN(CC1)C(=O)NC2=CC=CC=C2C(=O)NC3=NC=C(C=C3)Cl

InChI

InChI=1S/C21H26ClN5O2/c1-21(2,3)27-12-10-26(11-13-27)20(29)24-17-7-5-4-6-16(17)19(28)25-18-9-8-15(22)14-23-18/h4-9,14H,10-13H2,1-3H3,(H,24,29)(H,23,25,28)