tert-butyl-[2-[[5-(4-chlorophenyl)-4-pyridin-4-yl-1H-pyrazol-3-yl]amino]ethyl]carbamic acid

Systemtic Name: tert-butyl-[2-[[5-(4-chlorophenyl)-4-pyridin-4-yl-1H-pyrazol-3-yl]amino]ethyl]carbamic acid Openeye Name: tert-butyl-[2-[[5-(4-chlorophenyl)-4-(4-pyridyl)-1H-pyrazol-3-yl]amino]ethyl]carbamic acid CAS Name: tert-butyl-[2-[[5-(4-chlorophenyl)-4-pyridin-4-yl-1H-pyrazol-3-yl]amino]ethyl]carbamic acid IUPAC Name: tert-butyl-[2-[[5-(4-chlorophenyl)-4-pyridin-4-yl-1H-pyrazol-3-yl]amino]ethyl]carbamic acid Traditional Name: tert-butyl-[2-[[5-(4-chlorophenyl)-4-(4-pyridyl)-1H-pyrazol-3-yl]amino]ethyl]carbamic acid Formula: C21H24ClN5O2 MolecularWeight: 413.90056

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N(CCNC1=NNC(=C1C2=CC=NC=C2)C3=CC=C(C=C3)Cl)C(=O)O

Isomeric SMILES

CC(C)(C)N(CCNC1=NNC(=C1C2=CC=NC=C2)C3=CC=C(C=C3)Cl)C(=O)O

InChI

InChI=1S/C21H24ClN5O2/c1-21(2,3)27(20(28)29)13-12-24-19-17(14-8-10-23-11-9-14)18(25-26-19)15-4-6-16(22)7-5-15/h4-11H,12-13H2,1-3H3,(H,28,29)(H2,24,25,26)