6-chloranyl-N-(2,3-dimethylphenyl)-2-[(4-methoxyphenyl)methylsulfanyl]pyrimidin-4-amine

Systemtic Name: 6-chloranyl-N-(2,3-dimethylphenyl)-2-[(4-methoxyphenyl)methylsulfanyl]pyrimidin-4-amine Openeye Name: 6-chloro-N-(2,3-dimethylphenyl)-2-[(4-methoxyphenyl)methylsulfanyl]pyrimidin-4-amine CAS Name: 6-chloro-N-(2,3-dimethylphenyl)-2-[(4-methoxyphenyl)methylthio]-4-pyrimidinamine IUPAC Name: 6-chloro-N-(2,3-dimethylphenyl)-2-[(4-methoxyphenyl)methylsulfanyl]pyrimidin-4-amine Traditional Name: [6-chloro-2-(p-anisylthio)pyrimidin-4-yl]-(2,3-dimethylphenyl)amine Formula: C20H20ClN3OS MolecularWeight: 385.9103

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC2=CC(=NC(=N2)SCC3=CC=C(C=C3)OC)Cl)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC2=CC(=NC(=N2)SCC3=CC=C(C=C3)OC)Cl)C

InChI

InChI=1S/C20H20ClN3OS/c1-13-5-4-6-17(14(13)2)22-19-11-18(21)23-20(24-19)26-12-15-7-9-16(25-3)10-8-15/h4-11H,12H2,1-3H3,(H,22,23,24)