3-[[5-(4-chlorophenyl)-4-pyridin-4-yl-1H-pyrazol-3-yl]amino]propylcarbamic acid

Systemtic Name: 3-[[5-(4-chlorophenyl)-4-pyridin-4-yl-1H-pyrazol-3-yl]amino]propylcarbamic acid Openeye Name: 3-[[5-(4-chlorophenyl)-4-(4-pyridyl)-1H-pyrazol-3-yl]amino]propylcarbamic acid CAS Name: 3-[[5-(4-chlorophenyl)-4-pyridin-4-yl-1H-pyrazol-3-yl]amino]propylcarbamic acid IUPAC Name: 3-[[5-(4-chlorophenyl)-4-pyridin-4-yl-1H-pyrazol-3-yl]amino]propylcarbamic acid Traditional Name: 3-[[5-(4-chlorophenyl)-4-(4-pyridyl)-1H-pyrazol-3-yl]amino]propylcarbamic acid Formula: C18H18ClN5O2 MolecularWeight: 371.82082

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=C(C(=NN2)NCCCNC(=O)O)C3=CC=NC=C3)Cl

Isomeric SMILES

C1=CC(=CC=C1C2=C(C(=NN2)NCCCNC(=O)O)C3=CC=NC=C3)Cl

InChI

InChI=1S/C18H18ClN5O2/c19-14-4-2-13(3-5-14)16-15(12-6-10-20-11-7-12)17(24-23-16)21-8-1-9-22-18(25)26/h2-7,10-11,22H,1,8-9H2,(H,25,26)(H2,21,23,24)