[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]-(2-pyrrolidin-1-ylpyridin-3-yl)methanone

Systemtic Name: [4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]-(2-pyrrolidin-1-ylpyridin-3-yl)methanone Openeye Name: [4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]-(2-pyrrolidin-1-yl-3-pyridyl)methanone CAS Name: [4-(4-ethoxyphenyl)sulfonyl-1-piperazinyl]-[2-(1-pyrrolidinyl)-3-pyridinyl]methanone IUPAC Name: [4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]-(2-pyrrolidin-1-ylpyridin-3-yl)methanone Traditional Name: (4-p-phenetylsulfonylpiperazino)-(2-pyrrolidino-3-pyridyl)methanone Formula: C22H28N4O4S MolecularWeight: 444.54712

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=C(N=CC=C3)N4CCCC4

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=C(N=CC=C3)N4CCCC4

InChI

InChI=1S/C22H28N4O4S/c1-2-30-18-7-9-19(10-8-18)31(28,29)26-16-14-25(15-17-26)22(27)20-6-5-11-23-21(20)24-12-3-4-13-24/h5-11H,2-4,12-17H2,1H3