[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-(2-ethoxypyridin-3-yl)methanone

Systemtic Name: [4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-(2-ethoxypyridin-3-yl)methanone Openeye Name: [4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-(2-ethoxy-3-pyridyl)methanone CAS Name: [4-(3,4-dimethylphenyl)sulfonyl-1-piperazinyl]-(2-ethoxy-3-pyridinyl)methanone IUPAC Name: [4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-(2-ethoxypyridin-3-yl)methanone Traditional Name: [4-(3,4-dimethylphenyl)sulfonylpiperazino]-(2-ethoxy-3-pyridyl)methanone Formula: C20H25N3O4S MolecularWeight: 403.4952

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC=N1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)C)C

Isomeric SMILES

CCOC1=C(C=CC=N1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)C)C

InChI

InChI=1S/C20H25N3O4S/c1-4-27-19-18(6-5-9-21-19)20(24)22-10-12-23(13-11-22)28(25,26)17-8-7-15(2)16(3)14-17/h5-9,14H,4,10-13H2,1-3H3