1-(3-methoxyphenyl)-4-(3-piperidin-1-ylsulfonylpyridin-4-yl)piperazine

Systemtic Name: 1-(3-methoxyphenyl)-4-(3-piperidin-1-ylsulfonylpyridin-4-yl)piperazine Openeye Name: 1-(3-methoxyphenyl)-4-[3-(1-piperidylsulfonyl)-4-pyridyl]piperazine CAS Name: 1-(3-methoxyphenyl)-4-[3-(1-piperidinylsulfonyl)-4-pyridinyl]piperazine IUPAC Name: 1-(3-methoxyphenyl)-4-(3-piperidin-1-ylsulfonylpyridin-4-yl)piperazine Traditional Name: 1-(3-methoxyphenyl)-4-(3-piperidinosulfonyl-4-pyridyl)piperazine Formula: C21H28N4O3S MolecularWeight: 416.53702

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2CCN(CC2)C3=C(C=NC=C3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

COC1=CC=CC(=C1)N2CCN(CC2)C3=C(C=NC=C3)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C21H28N4O3S/c1-28-19-7-5-6-18(16-19)23-12-14-24(15-13-23)20-8-9-22-17-21(20)29(26,27)25-10-3-2-4-11-25/h5-9,16-17H,2-4,10-15H2,1H3