N-(4-ethoxyphenyl)-N-methyl-4-oxidanylidene-3-(4-phenylpiperazin-1-yl)carbonyl-1H-quinoline-6-sulfonamide

Systemtic Name: N-(4-ethoxyphenyl)-N-methyl-4-oxidanylidene-3-(4-phenylpiperazin-1-yl)carbonyl-1H-quinoline-6-sulfonamide Openeye Name: N-(4-ethoxyphenyl)-N-methyl-4-oxo-3-(4-phenylpiperazine-1-carbonyl)-1H-quinoline-6-sulfonamide CAS Name: N-(4-ethoxyphenyl)-N-methyl-4-oxo-3-[oxo-(4-phenyl-1-piperazinyl)methyl]-1H-quinoline-6-sulfonamide IUPAC Name: N-(4-ethoxyphenyl)-N-methyl-4-oxo-3-(4-phenylpiperazine-1-carbonyl)-1H-quinoline-6-sulfonamide Traditional Name: 4-keto-N-methyl-3-(4-phenylpiperazine-1-carbonyl)-N-p-phenetyl-1H-quinoline-6-sulfonamide Formula: C29H30N4O5S MolecularWeight: 546.6373

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N(C)S(=O)(=O)C2=CC3=C(C=C2)NC=C(C3=O)C(=O)N4CCN(CC4)C5=CC=CC=C5

Isomeric SMILES

CCOC1=CC=C(C=C1)N(C)S(=O)(=O)C2=CC3=C(C=C2)NC=C(C3=O)C(=O)N4CCN(CC4)C5=CC=CC=C5

InChI

InChI=1S/C29H30N4O5S/c1-3-38-23-11-9-21(10-12-23)31(2)39(36,37)24-13-14-27-25(19-24)28(34)26(20-30-27)29(35)33-17-15-32(16-18-33)22-7-5-4-6-8-22/h4-14,19-20H,3,15-18H2,1-2H3,(H,30,34)