[4-[(3-chloranyl-4-methoxy-phenyl)methylamino]-2-methylsulfanyl-pyrimidin-5-yl]-(1-methylimidazol-2-yl)methanone

Systemtic Name: [4-[(3-chloranyl-4-methoxy-phenyl)methylamino]-2-methylsulfanyl-pyrimidin-5-yl]-(1-methylimidazol-2-yl)methanone Openeye Name: [4-[(3-chloro-4-methoxy-phenyl)methylamino]-2-methylsulfanyl-pyrimidin-5-yl]-(1-methylimidazol-2-yl)methanone CAS Name: [4-[(3-chloro-4-methoxyphenyl)methylamino]-2-(methylthio)-5-pyrimidinyl]-(1-methyl-2-imidazolyl)methanone IUPAC Name: [4-[(3-chloro-4-methoxyphenyl)methylamino]-2-methylsulfanylpyrimidin-5-yl]-(1-methylimidazol-2-yl)methanone Traditional Name: [4-[(3-chloro-4-methoxy-benzyl)amino]-2-(methylthio)pyrimidin-5-yl]-(1-methylimidazol-2-yl)methanone Formula: C18H18ClN5O2S MolecularWeight: 403.88582

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1C(=O)C2=CN=C(N=C2NCC3=CC(=C(C=C3)OC)Cl)SC

Isomeric SMILES

CN1C=CN=C1C(=O)C2=CN=C(N=C2NCC3=CC(=C(C=C3)OC)Cl)SC

InChI

InChI=1S/C18H18ClN5O2S/c1-24-7-6-20-17(24)15(25)12-10-22-18(27-3)23-16(12)21-9-11-4-5-14(26-2)13(19)8-11/h4-8,10H,9H2,1-3H3,(H,21,22,23)