1-(2-ethoxyphenyl)-4-(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)piperazine

Systemtic Name: 1-(2-ethoxyphenyl)-4-(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)piperazine Openeye Name: 1-(2-ethoxyphenyl)-4-(5-pyrrolidin-1-ylsulfonyl-2-pyridyl)piperazine CAS Name: 1-(2-ethoxyphenyl)-4-[5-(1-pyrrolidinylsulfonyl)-2-pyridinyl]piperazine IUPAC Name: 1-(2-ethoxyphenyl)-4-(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)piperazine Traditional Name: 1-o-phenetyl-4-(5-pyrrolidinosulfonyl-2-pyridyl)piperazine Formula: C21H28N4O3S MolecularWeight: 416.53702

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2CCN(CC2)C3=NC=C(C=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

CCOC1=CC=CC=C1N2CCN(CC2)C3=NC=C(C=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C21H28N4O3S/c1-2-28-20-8-4-3-7-19(20)23-13-15-24(16-14-23)21-10-9-18(17-22-21)29(26,27)25-11-5-6-12-25/h3-4,7-10,17H,2,5-6,11-16H2,1H3