N-[4-chloranyl-6-(4-methylpiperazin-1-yl)-5-methylsulfanyl-pyrimidin-2-yl]-N-methyl-benzamide

Systemtic Name: N-[4-chloranyl-6-(4-methylpiperazin-1-yl)-5-methylsulfanyl-pyrimidin-2-yl]-N-methyl-benzamide Openeye Name: N-[4-chloro-6-(4-methylpiperazin-1-yl)-5-methylsulfanyl-pyrimidin-2-yl]-N-methyl-benzamide CAS Name: N-[4-chloro-6-(4-methyl-1-piperazinyl)-5-(methylthio)-2-pyrimidinyl]-N-methylbenzamide IUPAC Name: N-[4-chloro-6-(4-methylpiperazin-1-yl)-5-methylsulfanylpyrimidin-2-yl]-N-methylbenzamide Traditional Name: N-[4-chloro-6-(4-methylpiperazino)-5-(methylthio)pyrimidin-2-yl]-N-methyl-benzamide Formula: C18H22ClN5OS MolecularWeight: 391.91818

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C(C(=NC(=N2)N(C)C(=O)C3=CC=CC=C3)Cl)SC

Isomeric SMILES

CN1CCN(CC1)C2=C(C(=NC(=N2)N(C)C(=O)C3=CC=CC=C3)Cl)SC

InChI

InChI=1S/C18H22ClN5OS/c1-22-9-11-24(12-10-22)16-14(26-3)15(19)20-18(21-16)23(2)17(25)13-7-5-4-6-8-13/h4-8H,9-12H2,1-3H3