(4-methylpiperazin-1-yl)-[6-[1-(4-methylsulfonylphenyl)pyrazol-4-yl]pyridin-3-yl]methanone

Systemtic Name: (4-methylpiperazin-1-yl)-[6-[1-(4-methylsulfonylphenyl)pyrazol-4-yl]pyridin-3-yl]methanone Openeye Name: (4-methylpiperazin-1-yl)-[6-[1-(4-methylsulfonylphenyl)pyrazol-4-yl]-3-pyridyl]methanone CAS Name: (4-methyl-1-piperazinyl)-[6-[1-(4-methylsulfonylphenyl)-4-pyrazolyl]-3-pyridinyl]methanone IUPAC Name: (4-methylpiperazin-1-yl)-[6-[1-(4-methylsulfonylphenyl)pyrazol-4-yl]pyridin-3-yl]methanone Traditional Name: [6-[1-(4-mesylphenyl)pyrazol-4-yl]-3-pyridyl]-(4-methylpiperazino)methanone Formula: C21H23N5O3S MolecularWeight: 425.50402

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)C2=CN=C(C=C2)C3=CN(N=C3)C4=CC=C(C=C4)S(=O)(=O)C

Isomeric SMILES

CN1CCN(CC1)C(=O)C2=CN=C(C=C2)C3=CN(N=C3)C4=CC=C(C=C4)S(=O)(=O)C

InChI

InChI=1S/C21H23N5O3S/c1-24-9-11-25(12-10-24)21(27)16-3-8-20(22-13-16)17-14-23-26(15-17)18-4-6-19(7-5-18)30(2,28)29/h3-8,13-15H,9-12H2,1-2H3