4,5-bis(2-dimethylaminoethylsulfanylmethyl)-10H-acridin-9-one dihydrochloride

Systemtic Name: 4,5-bis(2-dimethylaminoethylsulfanylmethyl)-10H-acridin-9-one dihydrochloride Openeye Name: 4,5-bis(2-dimethylaminoethylsulfanylmethyl)-10H-acridin-9-one dihydrochloride CAS Name: 4,5-bis[(2-dimethylaminoethylthio)methyl]-10H-acridin-9-one dihydrochloride IUPAC Name: 4,5-bis(2-dimethylaminoethylsulfanylmethyl)-10H-acridin-9-one dihydrochloride Traditional Name: 4,5-bis[(2-dimethylaminoethylthio)methyl]-10H-acridin-9-one dihydrochloride Formula: C23H33Cl2N3OS2 MolecularWeight: 502.56362

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCSCC1=CC=CC2=C1NC3=C(C2=O)C=CC=C3CSCCN(C)C.Cl.Cl

Isomeric SMILES

CN(C)CCSCC1=CC=CC2=C1NC3=C(C2=O)C=CC=C3CSCCN(C)C.Cl.Cl

InChI

InChI=1S/C23H31N3OS2.2ClH/c1-25(2)11-13-28-15-17-7-5-9-19-21(17)24-22-18(16-29-14-12-26(3)4)8-6-10-20(22)23(19)27;;/h5-10H,11-16H2,1-4H3,(H,24,27);2*1H