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

Systemtic Name: 4-[3-(2-dimethylaminoethylsulfanyl)-5-methyl-1,2-oxazol-4-yl]-N-phenyl-pyrimidin-2-amine Openeye Name: 4-[3-(2-dimethylaminoethylsulfanyl)-5-methyl-isoxazol-4-yl]-N-phenyl-pyrimidin-2-amine CAS Name: 4-[3-(2-dimethylaminoethylthio)-5-methyl-4-isoxazolyl]-N-phenyl-2-pyrimidinamine IUPAC Name: 4-[3-(2-dimethylaminoethylsulfanyl)-5-methyl-1,2-oxazol-4-yl]-N-phenylpyrimidin-2-amine Traditional Name: 2-[[4-(2-anilinopyrimidin-4-yl)-5-methyl-isoxazol-3-yl]thio]ethyl-dimethyl-amine Formula: C18H21N5OS MolecularWeight: 355.45724

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)SCCN(C)C)C2=NC(=NC=C2)NC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=NO1)SCCN(C)C)C2=NC(=NC=C2)NC3=CC=CC=C3

InChI

InChI=1S/C18H21N5OS/c1-13-16(17(22-24-13)25-12-11-23(2)3)15-9-10-19-18(21-15)20-14-7-5-4-6-8-14/h4-10H,11-12H2,1-3H3,(H,19,20,21)