1-[4-[(4,6-dimethylpyrimidin-2-yl)-ethyl-amino]-3-methylsulfanyl-phenyl]ethanone

Systemtic Name: 1-[4-[(4,6-dimethylpyrimidin-2-yl)-ethyl-amino]-3-methylsulfanyl-phenyl]ethanone Openeye Name: 1-[4-[(4,6-dimethylpyrimidin-2-yl)-ethyl-amino]-3-methylsulfanyl-phenyl]ethanone CAS Name: 1-[4-[(4,6-dimethyl-2-pyrimidinyl)-ethylamino]-3-(methylthio)phenyl]ethanone IUPAC Name: 1-[4-[(4,6-dimethylpyrimidin-2-yl)-ethylamino]-3-methylsulfanylphenyl]ethanone Traditional Name: 1-[4-[(4,6-dimethylpyrimidin-2-yl)-ethyl-amino]-3-(methylthio)phenyl]ethanone Formula: C17H21N3OS MolecularWeight: 315.43314

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=C(C=C(C=C1)C(=O)C)SC)C2=NC(=CC(=N2)C)C

Isomeric SMILES

CCN(C1=C(C=C(C=C1)C(=O)C)SC)C2=NC(=CC(=N2)C)C

InChI

InChI=1S/C17H21N3OS/c1-6-20(17-18-11(2)9-12(3)19-17)15-8-7-14(13(4)21)10-16(15)22-5/h7-10H,6H2,1-5H3