N-(3-chloranyl-4-methoxy-phenyl)-2-methylsulfanyl-6-phenyl-pyrimidin-4-amine

Systemtic Name: N-(3-chloranyl-4-methoxy-phenyl)-2-methylsulfanyl-6-phenyl-pyrimidin-4-amine Openeye Name: N-(3-chloro-4-methoxy-phenyl)-2-methylsulfanyl-6-phenyl-pyrimidin-4-amine CAS Name: N-(3-chloro-4-methoxyphenyl)-2-(methylthio)-6-phenyl-4-pyrimidinamine IUPAC Name: N-(3-chloro-4-methoxyphenyl)-2-methylsulfanyl-6-phenylpyrimidin-4-amine Traditional Name: (3-chloro-4-methoxy-phenyl)-[2-(methylthio)-6-phenyl-pyrimidin-4-yl]amine Formula: C18H16ClN3OS MolecularWeight: 357.85714

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC2=NC(=NC(=C2)C3=CC=CC=C3)SC)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)NC2=NC(=NC(=C2)C3=CC=CC=C3)SC)Cl

InChI

InChI=1S/C18H16ClN3OS/c1-23-16-9-8-13(10-14(16)19)20-17-11-15(21-18(22-17)24-2)12-6-4-3-5-7-12/h3-11H,1-2H3,(H,20,21,22)