3,5-bis(chloranyl)-4-[[2-[2-(4-chlorophenyl)ethyl]-2-(imidazol-1-ylmethyl)-1,3-dioxolan-4-yl]methylsulfanyl]aniline

Systemtic Name: 3,5-bis(chloranyl)-4-[[2-[2-(4-chlorophenyl)ethyl]-2-(imidazol-1-ylmethyl)-1,3-dioxolan-4-yl]methylsulfanyl]aniline Openeye Name: 3,5-dichloro-4-[[2-[2-(4-chlorophenyl)ethyl]-2-(imidazol-1-ylmethyl)-1,3-dioxolan-4-yl]methylsulfanyl]aniline CAS Name: 3,5-dichloro-4-[[2-[2-(4-chlorophenyl)ethyl]-2-(1-imidazolylmethyl)-1,3-dioxolan-4-yl]methylthio]aniline IUPAC Name: 3,5-dichloro-4-[[2-[2-(4-chlorophenyl)ethyl]-2-(imidazol-1-ylmethyl)-1,3-dioxolan-4-yl]methylsulfanyl]aniline Traditional Name: [3,5-dichloro-4-[[2-[2-(4-chlorophenyl)ethyl]-2-(imidazol-1-ylmethyl)-1,3-dioxolan-4-yl]methylthio]phenyl]amine Formula: C22H22Cl3N3O2S MolecularWeight: 498.85298

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC(O1)(CCC2=CC=C(C=C2)Cl)CN3C=CN=C3)CSC4=C(C=C(C=C4Cl)N)Cl

Isomeric SMILES

C1C(OC(O1)(CCC2=CC=C(C=C2)Cl)CN3C=CN=C3)CSC4=C(C=C(C=C4Cl)N)Cl

InChI

InChI=1S/C22H22Cl3N3O2S/c23-16-3-1-15(2-4-16)5-6-22(13-28-8-7-27-14-28)29-11-18(30-22)12-31-21-19(24)9-17(26)10-20(21)25/h1-4,7-10,14,18H,5-6,11-13,26H2