1-[(2,5-dimethoxyphenyl)methyl]-4-(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)piperazine

Systemtic Name: 1-[(2,5-dimethoxyphenyl)methyl]-4-(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)piperazine Openeye Name: 1-[(2,5-dimethoxyphenyl)methyl]-4-(5-pyrrolidin-1-ylsulfonyl-2-pyridyl)piperazine CAS Name: 1-[(2,5-dimethoxyphenyl)methyl]-4-[5-(1-pyrrolidinylsulfonyl)-2-pyridinyl]piperazine IUPAC Name: 1-[(2,5-dimethoxyphenyl)methyl]-4-(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)piperazine Traditional Name: 1-(2,5-dimethoxybenzyl)-4-(5-pyrrolidinosulfonyl-2-pyridyl)piperazine Formula: C22H30N4O4S MolecularWeight: 446.563

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)CN2CCN(CC2)C3=NC=C(C=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

COC1=CC(=C(C=C1)OC)CN2CCN(CC2)C3=NC=C(C=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C22H30N4O4S/c1-29-19-5-7-21(30-2)18(15-19)17-24-11-13-25(14-12-24)22-8-6-20(16-23-22)31(27,28)26-9-3-4-10-26/h5-8,15-16H,3-4,9-14,17H2,1-2H3