tert-butyl N-[3-[[5-(4-chlorophenyl)-4-pyridin-4-yl-1H-pyrazol-3-yl]amino]propyl]carbamate

Systemtic Name: tert-butyl N-[3-[[5-(4-chlorophenyl)-4-pyridin-4-yl-1H-pyrazol-3-yl]amino]propyl]carbamate Openeye Name: tert-butyl N-[3-[[5-(4-chlorophenyl)-4-(4-pyridyl)-1H-pyrazol-3-yl]amino]propyl]carbamate CAS Name: N-[3-[[5-(4-chlorophenyl)-4-pyridin-4-yl-1H-pyrazol-3-yl]amino]propyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[3-[[5-(4-chlorophenyl)-4-pyridin-4-yl-1H-pyrazol-3-yl]amino]propyl]carbamate Traditional Name: N-[3-[[5-(4-chlorophenyl)-4-(4-pyridyl)-1H-pyrazol-3-yl]amino]propyl]carbamic acid tert-butyl ester Formula: C22H26ClN5O2 MolecularWeight: 427.92714

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCCNC1=NNC(=C1C2=CC=NC=C2)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C)(C)OC(=O)NCCCNC1=NNC(=C1C2=CC=NC=C2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C22H26ClN5O2/c1-22(2,3)30-21(29)26-12-4-11-25-20-18(15-9-13-24-14-10-15)19(27-28-20)16-5-7-17(23)8-6-16/h5-10,13-14H,4,11-12H2,1-3H3,(H,26,29)(H2,25,27,28)