N-[2-(2-chloroethylsulfanyl)ethyl]-4-methoxy-acridin-9-amine hydrate hydrochloride

Systemtic Name: N-[2-(2-chloroethylsulfanyl)ethyl]-4-methoxy-acridin-9-amine hydrate hydrochloride Openeye Name: N-[2-(2-chloroethylsulfanyl)ethyl]-4-methoxy-acridin-9-amine hydrate hydrochloride CAS Name: N-[2-(2-chloroethylthio)ethyl]-4-methoxy-9-acridinamine hydrate hydrochloride IUPAC Name: N-[2-(2-chloroethylsulfanyl)ethyl]-4-methoxyacridin-9-amine hydrate hydrochloride Traditional Name: 2-(2-chloroethylthio)ethyl-(4-methoxyacridin-9-yl)amine hydrate hydrochloride Formula: C18H22Cl2N2O2S MolecularWeight: 401.35048

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C(C3=CC=CC=C3N=C21)NCCSCCCl.O.Cl

Isomeric SMILES

COC1=CC=CC2=C(C3=CC=CC=C3N=C21)NCCSCCCl.O.Cl

InChI

InChI=1S/C18H19ClN2OS.ClH.H2O/c1-22-16-8-4-6-14-17(20-10-12-23-11-9-19)13-5-2-3-7-15(13)21-18(14)16;;/h2-8H,9-12H2,1H3,(H,20,21);1H;1H2