N-(2-diethylaminoethyl)-4-[3-(4-piperidin-1-ylphenyl)-1H-pyrazol-5-yl]benzamide

Systemtic Name: N-(2-diethylaminoethyl)-4-[3-(4-piperidin-1-ylphenyl)-1H-pyrazol-5-yl]benzamide Openeye Name: N-(2-diethylaminoethyl)-4-[3-[4-(1-piperidyl)phenyl]-1H-pyrazol-5-yl]benzamide CAS Name: N-(2-diethylaminoethyl)-4-[3-[4-(1-piperidinyl)phenyl]-1H-pyrazol-5-yl]benzamide IUPAC Name: N-(2-diethylaminoethyl)-4-[3-(4-piperidin-1-ylphenyl)-1H-pyrazol-5-yl]benzamide Traditional Name: N-(2-diethylaminoethyl)-4-[3-(4-piperidinophenyl)-1H-pyrazol-5-yl]benzamide Formula: C27H35N5O MolecularWeight: 445.5997

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC(=O)C1=CC=C(C=C1)C2=CC(=NN2)C3=CC=C(C=C3)N4CCCCC4

Isomeric SMILES

CCN(CC)CCNC(=O)C1=CC=C(C=C1)C2=CC(=NN2)C3=CC=C(C=C3)N4CCCCC4

InChI

InChI=1S/C27H35N5O/c1-3-31(4-2)19-16-28-27(33)23-10-8-21(9-11-23)25-20-26(30-29-25)22-12-14-24(15-13-22)32-17-6-5-7-18-32/h8-15,20H,3-7,16-19H2,1-2H3,(H,28,33)(H,29,30)