[5-chloranyl-7-[(4-methylpiperazin-1-yl)methyl]quinolin-8-yl] phenothiazine-10-carboxylate

Systemtic Name: [5-chloranyl-7-[(4-methylpiperazin-1-yl)methyl]quinolin-8-yl] phenothiazine-10-carboxylate Openeye Name: [5-chloro-7-[(4-methylpiperazin-1-yl)methyl]-8-quinolyl] phenothiazine-10-carboxylate CAS Name: 10-phenothiazinecarboxylic acid [5-chloro-7-[(4-methyl-1-piperazinyl)methyl]-8-quinolinyl] ester IUPAC Name: [5-chloro-7-[(4-methylpiperazin-1-yl)methyl]quinolin-8-yl] phenothiazine-10-carboxylate Traditional Name: phenothiazine-10-carboxylic acid [5-chloro-7-[(4-methylpiperazino)methyl]-8-quinolyl] ester Formula: C28H25ClN4O2S MolecularWeight: 517.0417

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CC2=CC(=C3C=CC=NC3=C2OC(=O)N4C5=CC=CC=C5SC6=CC=CC=C64)Cl

Isomeric SMILES

CN1CCN(CC1)CC2=CC(=C3C=CC=NC3=C2OC(=O)N4C5=CC=CC=C5SC6=CC=CC=C64)Cl

InChI

InChI=1S/C28H25ClN4O2S/c1-31-13-15-32(16-14-31)18-19-17-21(29)20-7-6-12-30-26(20)27(19)35-28(34)33-22-8-2-4-10-24(22)36-25-11-5-3-9-23(25)33/h2-12,17H,13-16,18H2,1H3