S2,S7-bis(2-diethylaminoethyl) 9-oxidanylidenefluorene-2,7-dicarbothioate dihydrochloride

Systemtic Name: S2,S7-bis(2-diethylaminoethyl) 9-oxidanylidenefluorene-2,7-dicarbothioate dihydrochloride Openeye Name: S2,S7-bis(2-diethylaminoethyl) 9-oxofluorene-2,7-dicarbothioate dihydrochloride CAS Name: 9-oxofluorene-2,7-dicarbothioic acid S2,S7-bis(2-diethylaminoethyl) ester dihydrochloride IUPAC Name: 2-S,7-S-bis(2-diethylaminoethyl) 9-oxofluorene-2,7-dicarbothioate dihydrochloride Traditional Name: 9-ketofluorene-2,7-dicarbothioic acid S2,S7-bis(2-diethylaminoethyl) ester dihydrochloride Formula: C27H36Cl2N2O3S2 MolecularWeight: 571.62234

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCSC(=O)C1=CC2=C(C=C1)C3=C(C2=O)C=C(C=C3)C(=O)SCCN(CC)CC.Cl.Cl

Isomeric SMILES

CCN(CC)CCSC(=O)C1=CC2=C(C=C1)C3=C(C2=O)C=C(C=C3)C(=O)SCCN(CC)CC.Cl.Cl

InChI

InChI=1S/C27H34N2O3S2.2ClH/c1-5-28(6-2)13-15-33-26(31)19-9-11-21-22-12-10-20(18-24(22)25(30)23(21)17-19)27(32)34-16-14-29(7-3)8-4;;/h9-12,17-18H,5-8,13-16H2,1-4H3;2*1H