3-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]carbonyl-1-ethyl-6-morpholin-4-ylsulfonyl-quinolin-4-one

Systemtic Name: 3-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]carbonyl-1-ethyl-6-morpholin-4-ylsulfonyl-quinolin-4-one Openeye Name: 3-[4-(5-chloro-2-methyl-phenyl)piperazine-1-carbonyl]-1-ethyl-6-morpholinosulfonyl-quinolin-4-one CAS Name: 3-[[4-(5-chloro-2-methylphenyl)-1-piperazinyl]-oxomethyl]-1-ethyl-6-(4-morpholinylsulfonyl)-4-quinolinone IUPAC Name: 3-[4-(5-chloro-2-methylphenyl)piperazine-1-carbonyl]-1-ethyl-6-morpholin-4-ylsulfonylquinolin-4-one Traditional Name: 3-[4-(5-chloro-2-methyl-phenyl)piperazine-1-carbonyl]-1-ethyl-6-morpholinosulfonyl-4-quinolone Formula: C27H31ClN4O5S MolecularWeight: 559.07684

Click to see the large picture

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)Cl)C

Isomeric SMILES

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

InChI

InChI=1S/C27H31ClN4O5S/c1-3-29-18-23(27(34)31-10-8-30(9-11-31)25-16-20(28)5-4-19(25)2)26(33)22-17-21(6-7-24(22)29)38(35,36)32-12-14-37-15-13-32/h4-7,16-18H,3,8-15H2,1-2H3