4,10-bis[(5-chloranyl-8-oxidanyl-quinolin-7-yl)methyl]-1,7,13-trithia-4,10-diazacyclohexadecan-15-ol

Systemtic Name: 4,10-bis[(5-chloranyl-8-oxidanyl-quinolin-7-yl)methyl]-1,7,13-trithia-4,10-diazacyclohexadecan-15-ol Openeye Name: 4,10-bis[(5-chloro-8-hydroxy-7-quinolyl)methyl]-1,7,13-trithia-4,10-diazacyclohexadecan-15-ol CAS Name: 4,10-bis[(5-chloro-8-hydroxy-7-quinolinyl)methyl]-1,7,13-trithia-4,10-diazacyclohexadecan-15-ol IUPAC Name: 4,10-bis[(5-chloro-8-hydroxyquinolin-7-yl)methyl]-1,7,13-trithia-4,10-diazacyclohexadecan-15-ol Traditional Name: 4,10-bis[(5-chloro-8-hydroxy-7-quinolyl)methyl]-1,7,13-trithia-4,10-diazacyclohexadecan-15-ol Formula: C31H36Cl2N4O3S3 MolecularWeight: 679.74354

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Descriptors Computed from Structure

Canonical SMILES:

C1CSCCN(CCSCC(CSCCN1CC2=CC(=C3C=CC=NC3=C2O)Cl)O)CC4=CC(=C5C=CC=NC5=C4O)Cl

Isomeric SMILES

C1CSCCN(CCSCC(CSCCN1CC2=CC(=C3C=CC=NC3=C2O)Cl)O)CC4=CC(=C5C=CC=NC5=C4O)Cl

InChI

InChI=1S/C31H36Cl2N4O3S3/c32-26-15-21(30(39)28-24(26)3-1-5-34-28)17-36-7-11-41-12-8-37(10-14-43-20-23(38)19-42-13-9-36)18-22-16-27(33)25-4-2-6-35-29(25)31(22)40/h1-6,15-16,23,38-40H,7-14,17-20H2