2-azanyl-3-(4-tert-butylpiperazin-1-yl)carbonyl-N-(5-chloranylpyridin-2-yl)benzamide

Systemtic Name: 2-azanyl-3-(4-tert-butylpiperazin-1-yl)carbonyl-N-(5-chloranylpyridin-2-yl)benzamide Openeye Name: 2-amino-3-(4-tert-butylpiperazine-1-carbonyl)-N-(5-chloro-2-pyridyl)benzamide CAS Name: 2-amino-3-[(4-tert-butyl-1-piperazinyl)-oxomethyl]-N-(5-chloro-2-pyridinyl)benzamide IUPAC Name: 2-amino-3-(4-tert-butylpiperazine-1-carbonyl)-N-(5-chloropyridin-2-yl)benzamide Traditional Name: 2-amino-3-(4-tert-butylpiperazine-1-carbonyl)-N-(5-chloro-2-pyridyl)benzamide Formula: C21H26ClN5O2 MolecularWeight: 415.91644

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1CCN(CC1)C(=O)C2=C(C(=CC=C2)C(=O)NC3=NC=C(C=C3)Cl)N

Isomeric SMILES

CC(C)(C)N1CCN(CC1)C(=O)C2=C(C(=CC=C2)C(=O)NC3=NC=C(C=C3)Cl)N

InChI

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