4-(5-methyl-3-pentylsulfanyl-1,2-oxazol-4-yl)-N-phenyl-pyrimidin-2-amine

Systemtic Name: 4-(5-methyl-3-pentylsulfanyl-1,2-oxazol-4-yl)-N-phenyl-pyrimidin-2-amine Openeye Name: 4-(5-methyl-3-pentylsulfanyl-isoxazol-4-yl)-N-phenyl-pyrimidin-2-amine CAS Name: 4-[5-methyl-3-(pentylthio)-4-isoxazolyl]-N-phenyl-2-pyrimidinamine IUPAC Name: 4-(5-methyl-3-pentylsulfanyl-1,2-oxazol-4-yl)-N-phenylpyrimidin-2-amine Traditional Name: [4-[3-(amylthio)-5-methyl-isoxazol-4-yl]pyrimidin-2-yl]-phenyl-amine Formula: C19H22N4OS MolecularWeight: 354.46918

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCSC1=NOC(=C1C2=NC(=NC=C2)NC3=CC=CC=C3)C

Isomeric SMILES

CCCCCSC1=NOC(=C1C2=NC(=NC=C2)NC3=CC=CC=C3)C

InChI

InChI=1S/C19H22N4OS/c1-3-4-8-13-25-18-17(14(2)24-23-18)16-11-12-20-19(22-16)21-15-9-6-5-7-10-15/h5-7,9-12H,3-4,8,13H2,1-2H3,(H,20,21,22)