[4-[[3-(3-methoxyphenyl)-1H-pyrazol-5-yl]carbonyl]piperazin-1-yl]-pyridin-3-yl-methanone

Systemtic Name: [4-[[3-(3-methoxyphenyl)-1H-pyrazol-5-yl]carbonyl]piperazin-1-yl]-pyridin-3-yl-methanone Openeye Name: [4-[3-(3-methoxyphenyl)-1H-pyrazole-5-carbonyl]piperazin-1-yl]-(3-pyridyl)methanone CAS Name: [4-[[3-(3-methoxyphenyl)-1H-pyrazol-5-yl]-oxomethyl]-1-piperazinyl]-(3-pyridinyl)methanone IUPAC Name: [4-[3-(3-methoxyphenyl)-1H-pyrazole-5-carbonyl]piperazin-1-yl]-pyridin-3-ylmethanone Traditional Name: [4-[3-(3-methoxyphenyl)-1H-pyrazole-5-carbonyl]piperazino]-(3-pyridyl)methanone Formula: C21H21N5O3 MolecularWeight: 391.42314

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=NNC(=C2)C(=O)N3CCN(CC3)C(=O)C4=CN=CC=C4

Isomeric SMILES

COC1=CC=CC(=C1)C2=NNC(=C2)C(=O)N3CCN(CC3)C(=O)C4=CN=CC=C4

InChI

InChI=1S/C21H21N5O3/c1-29-17-6-2-4-15(12-17)18-13-19(24-23-18)21(28)26-10-8-25(9-11-26)20(27)16-5-3-7-22-14-16/h2-7,12-14H,8-11H2,1H3,(H,23,24)