4-(3-butylsulfanyl-5-methyl-1,2-oxazol-4-yl)-N-(3-methylphenyl)pyrimidin-2-amine

Systemtic Name: 4-(3-butylsulfanyl-5-methyl-1,2-oxazol-4-yl)-N-(3-methylphenyl)pyrimidin-2-amine Openeye Name: 4-(3-butylsulfanyl-5-methyl-isoxazol-4-yl)-N-(m-tolyl)pyrimidin-2-amine CAS Name: 4-[3-(butylthio)-5-methyl-4-isoxazolyl]-N-(3-methylphenyl)-2-pyrimidinamine IUPAC Name: 4-(3-butylsulfanyl-5-methyl-1,2-oxazol-4-yl)-N-(3-methylphenyl)pyrimidin-2-amine Traditional Name: [4-[3-(butylthio)-5-methyl-isoxazol-4-yl]pyrimidin-2-yl]-(m-tolyl)amine Formula: C19H22N4OS MolecularWeight: 354.46918

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=NOC(=C1C2=NC(=NC=C2)NC3=CC=CC(=C3)C)C

Isomeric SMILES

CCCCSC1=NOC(=C1C2=NC(=NC=C2)NC3=CC=CC(=C3)C)C

InChI

InChI=1S/C19H22N4OS/c1-4-5-11-25-18-17(14(3)24-23-18)16-9-10-20-19(22-16)21-15-8-6-7-13(2)12-15/h6-10,12H,4-5,11H2,1-3H3,(H,20,21,22)