5-chloranyl-N2-(4-chlorophenyl)-N1,N1,N4-triethyl-2-methyl-1-methylsulfanyl-pyrimidin-1-ium-1,2,4-triamine

Systemtic Name: 5-chloranyl-N2-(4-chlorophenyl)-N1,N1,N4-triethyl-2-methyl-1-methylsulfanyl-pyrimidin-1-ium-1,2,4-triamine Openeye Name: 5-chloro-N2-(4-chlorophenyl)-N1,N1,N4-triethyl-2-methyl-1-methylsulfanyl-pyrimidin-1-ium-1,2,4-triamine CAS Name: 5-chloro-N2-(4-chlorophenyl)-N1,N1,N4-triethyl-2-methyl-1-(methylthio)pyrimidin-1-ium-1,2,4-triamine IUPAC Name: 5-chloro-2-N-(4-chlorophenyl)-1-N,1-N,4-N-triethyl-2-methyl-1-methylsulfanylpyrimidin-1-ium-1,2,4-triamine Traditional Name: [5-chloro-2-(4-chloroanilino)-4-(ethylamino)-2-methyl-1-(methylthio)pyrimidin-1-ium-1-yl]-diethyl-amine Formula: C18H28Cl2N5S+ MolecularWeight: 417.41942

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=NC([N+](C=C1Cl)(N(CC)CC)SC)(C)NC2=CC=C(C=C2)Cl

Isomeric SMILES

CCNC1=NC([N+](C=C1Cl)(N(CC)CC)SC)(C)NC2=CC=C(C=C2)Cl

InChI

InChI=1S/C18H28Cl2N5S/c1-6-21-17-16(20)13-25(26-5,24(7-2)8-3)18(4,23-17)22-15-11-9-14(19)10-12-15/h9-13,22H,6-8H2,1-5H3,(H,21,23)/q+1