5-chloranyl-N-[1-(2-diethylaminoethyl)benzimidazol-2-yl]-2-methylsulfanyl-pyrimidine-4-carboxamide

Systemtic Name: 5-chloranyl-N-[1-(2-diethylaminoethyl)benzimidazol-2-yl]-2-methylsulfanyl-pyrimidine-4-carboxamide Openeye Name: 5-chloro-N-[1-(2-diethylaminoethyl)benzimidazol-2-yl]-2-methylsulfanyl-pyrimidine-4-carboxamide CAS Name: 5-chloro-N-[1-(2-diethylaminoethyl)-2-benzimidazolyl]-2-(methylthio)-4-pyrimidinecarboxamide IUPAC Name: 5-chloro-N-[1-(2-diethylaminoethyl)benzimidazol-2-yl]-2-methylsulfanylpyrimidine-4-carboxamide Traditional Name: 5-chloro-N-[1-(2-diethylaminoethyl)benzimidazol-2-yl]-2-(methylthio)pyrimidine-4-carboxamide Formula: C19H23ClN6OS MolecularWeight: 418.94352

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN1C2=CC=CC=C2N=C1NC(=O)C3=NC(=NC=C3Cl)SC

Isomeric SMILES

CCN(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)