[5-[4-(aminomethyl)phenyl]-1-(6-methoxypyridin-3-yl)pyrazol-3-yl]-piperidin-1-yl-methanone

Systemtic Name: [5-[4-(aminomethyl)phenyl]-1-(6-methoxypyridin-3-yl)pyrazol-3-yl]-piperidin-1-yl-methanone Openeye Name: [5-[4-(aminomethyl)phenyl]-1-(6-methoxy-3-pyridyl)pyrazol-3-yl]-(1-piperidyl)methanone CAS Name: [5-[4-(aminomethyl)phenyl]-1-(6-methoxy-3-pyridinyl)-3-pyrazolyl]-(1-piperidinyl)methanone IUPAC Name: [5-[4-(aminomethyl)phenyl]-1-(6-methoxypyridin-3-yl)pyrazol-3-yl]-piperidin-1-ylmethanone Traditional Name: [5-[4-(aminomethyl)phenyl]-1-(6-methoxy-3-pyridyl)pyrazol-3-yl]-piperidino-methanone Formula: C22H25N5O2 MolecularWeight: 391.4662

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=NC=C(C=C1)N2C(=CC(=N2)C(=O)N3CCCCC3)C4=CC=C(C=C4)CN

Isomeric SMILES

COC1=NC=C(C=C1)N2C(=CC(=N2)C(=O)N3CCCCC3)C4=CC=C(C=C4)CN

InChI

InChI=1S/C22H25N5O2/c1-29-21-10-9-18(15-24-21)27-20(17-7-5-16(14-23)6-8-17)13-19(25-27)22(28)26-11-3-2-4-12-26/h5-10,13,15H,2-4,11-12,14,23H2,1H3