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

Systemtic Name: 4-(3-hexylsulfanyl-5-methyl-1,2-oxazol-4-yl)-N-phenyl-pyrimidin-2-amine Openeye Name: 4-(3-hexylsulfanyl-5-methyl-isoxazol-4-yl)-N-phenyl-pyrimidin-2-amine CAS Name: 4-[3-(hexylthio)-5-methyl-4-isoxazolyl]-N-phenyl-2-pyrimidinamine IUPAC Name: 4-(3-hexylsulfanyl-5-methyl-1,2-oxazol-4-yl)-N-phenylpyrimidin-2-amine Traditional Name: [4-[3-(hexylthio)-5-methyl-isoxazol-4-yl]pyrimidin-2-yl]-phenyl-amine Formula: C20H24N4OS MolecularWeight: 368.49576

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCSC1=NOC(=C1C2=NC(=NC=C2)NC3=CC=CC=C3)C

Isomeric SMILES

CCCCCCSC1=NOC(=C1C2=NC(=NC=C2)NC3=CC=CC=C3)C

InChI

InChI=1S/C20H24N4OS/c1-3-4-5-9-14-26-19-18(15(2)25-24-19)17-12-13-21-20(23-17)22-16-10-7-6-8-11-16/h6-8,10-13H,3-5,9,14H2,1-2H3,(H,21,22,23)