N-[5-(4-chlorophenyl)-4-pyridin-4-yl-1H-pyrazol-3-yl]-1-prop-2-ynyl-piperidin-4-amine

Systemtic Name: N-[5-(4-chlorophenyl)-4-pyridin-4-yl-1H-pyrazol-3-yl]-1-prop-2-ynyl-piperidin-4-amine Openeye Name: N-[5-(4-chlorophenyl)-4-(4-pyridyl)-1H-pyrazol-3-yl]-1-prop-2-ynyl-piperidin-4-amine CAS Name: N-[5-(4-chlorophenyl)-4-pyridin-4-yl-1H-pyrazol-3-yl]-1-prop-2-ynyl-4-piperidinamine IUPAC Name: N-[5-(4-chlorophenyl)-4-pyridin-4-yl-1H-pyrazol-3-yl]-1-prop-2-ynylpiperidin-4-amine Traditional Name: [5-(4-chlorophenyl)-4-(4-pyridyl)-1H-pyrazol-3-yl]-(1-propargyl-4-piperidyl)amine Formula: C22H22ClN5 MolecularWeight: 391.89658

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Descriptors Computed from Structure

Canonical SMILES:

C#CCN1CCC(CC1)NC2=NNC(=C2C3=CC=NC=C3)C4=CC=C(C=C4)Cl

Isomeric SMILES

C#CCN1CCC(CC1)NC2=NNC(=C2C3=CC=NC=C3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H22ClN5/c1-2-13-28-14-9-19(10-15-28)25-22-20(16-7-11-24-12-8-16)21(26-27-22)17-3-5-18(23)6-4-17/h1,3-8,11-12,19H,9-10,13-15H2,(H2,25,26,27)