2-[2-[(5-chloranyl-2-methylsulfanyl-pyrimidin-4-yl)carbonylamino]benzimidazol-1-yl]ethyl-diethyl-azanium

Systemtic Name: 2-[2-[(5-chloranyl-2-methylsulfanyl-pyrimidin-4-yl)carbonylamino]benzimidazol-1-yl]ethyl-diethyl-azanium Openeye Name: 2-[2-[(5-chloro-2-methylsulfanyl-pyrimidine-4-carbonyl)amino]benzimidazol-1-yl]ethyl-diethyl-ammonium CAS Name: 2-[2-[[[5-chloro-2-(methylthio)-4-pyrimidinyl]-oxomethyl]amino]-1-benzimidazolyl]ethyl-diethylammonium IUPAC Name: 2-[2-[(5-chloro-2-methylsulfanylpyrimidine-4-carbonyl)amino]benzimidazol-1-yl]ethyl-diethylazanium Traditional Name: 2-[2-[[5-chloro-2-(methylthio)pyrimidine-4-carbonyl]amino]benzimidazol-1-yl]ethyl-diethyl-ammonium Formula: C19H24ClN6OS+ MolecularWeight: 419.95146

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCN1C2=CC=CC=C2N=C1NC(=O)C3=NC(=NC=C3Cl)SC

Isomeric SMILES

CC[NH+](CC)CCN1C2=CC=CC=C2N=C1NC(=O)C3=NC(=NC=C3Cl)SC

InChI

InChI=1S/C19H23ClN6OS/c1-4-25(5-2)10-11-26-15-9-7-6-8-14(15)22-18(26)24-17(27)16-13(20)12-21-19(23-16)28-3/h6-9,12H,4-5,10-11H2,1-3H3,(H,22,24,27)/p+1