[6-methylsulfinyl-9-(2-thiomorpholin-4-ylethyl)-1,2,3,4-tetrahydrocarbazol-3-yl] 2-chloranylbenzenesulfonate

Systemtic Name: [6-methylsulfinyl-9-(2-thiomorpholin-4-ylethyl)-1,2,3,4-tetrahydrocarbazol-3-yl] 2-chloranylbenzenesulfonate Openeye Name: [6-methylsulfinyl-9-(2-thiomorpholinoethyl)-1,2,3,4-tetrahydrocarbazol-3-yl] 2-chlorobenzenesulfonate CAS Name: 2-chlorobenzenesulfonic acid [6-methylsulfinyl-9-(2-thiomorpholin-4-ylethyl)-1,2,3,4-tetrahydrocarbazol-3-yl] ester IUPAC Name: [6-methylsulfinyl-9-(2-thiomorpholin-4-ylethyl)-1,2,3,4-tetrahydrocarbazol-3-yl] 2-chlorobenzenesulfonate Traditional Name: 2-chlorobenzenesulfonic acid [6-methylsulfinyl-9-(2-thiomorpholinoethyl)-1,2,3,4-tetrahydrocarbazol-3-yl] ester Formula: C25H29ClN2O4S3 MolecularWeight: 553.15676

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)C1=CC2=C(C=C1)N(C3=C2CC(CC3)OS(=O)(=O)C4=CC=CC=C4Cl)CCN5CCSCC5

Isomeric SMILES

CS(=O)C1=CC2=C(C=C1)N(C3=C2CC(CC3)OS(=O)(=O)C4=CC=CC=C4Cl)CCN5CCSCC5

InChI

InChI=1S/C25H29ClN2O4S3/c1-34(29)19-7-9-24-21(17-19)20-16-18(32-35(30,31)25-5-3-2-4-22(25)26)6-8-23(20)28(24)11-10-27-12-14-33-15-13-27/h2-5,7,9,17-18H,6,8,10-16H2,1H3