3-[4-(2,5-dimethylphenyl)piperazin-1-yl]carbonyl-1-ethyl-6-morpholin-4-ylsulfonyl-quinolin-4-one

Systemtic Name: 3-[4-(2,5-dimethylphenyl)piperazin-1-yl]carbonyl-1-ethyl-6-morpholin-4-ylsulfonyl-quinolin-4-one Openeye Name: 3-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]-1-ethyl-6-morpholinosulfonyl-quinolin-4-one CAS Name: 3-[[4-(2,5-dimethylphenyl)-1-piperazinyl]-oxomethyl]-1-ethyl-6-(4-morpholinylsulfonyl)-4-quinolinone IUPAC Name: 3-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]-1-ethyl-6-morpholin-4-ylsulfonylquinolin-4-one Traditional Name: 3-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]-1-ethyl-6-morpholinosulfonyl-4-quinolone Formula: C28H34N4O5S MolecularWeight: 538.65836

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=C1C=CC(=C2)S(=O)(=O)N3CCOCC3)C(=O)N4CCN(CC4)C5=C(C=CC(=C5)C)C

Isomeric SMILES

CCN1C=C(C(=O)C2=C1C=CC(=C2)S(=O)(=O)N3CCOCC3)C(=O)N4CCN(CC4)C5=C(C=CC(=C5)C)C

InChI

InChI=1S/C28H34N4O5S/c1-4-29-19-24(28(34)31-11-9-30(10-12-31)26-17-20(2)5-6-21(26)3)27(33)23-18-22(7-8-25(23)29)38(35,36)32-13-15-37-16-14-32/h5-8,17-19H,4,9-16H2,1-3H3