3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)-N-[3-(1-phenylethoxy)propyl]propanamide

Systemtic Name: 3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)-N-[3-(1-phenylethoxy)propyl]propanamide Openeye Name: 3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)-N-[3-(1-phenylethoxy)propyl]propanamide CAS Name: 3-[4,6-dimethyl-2-(methylthio)-5-pyrimidinyl]-N-[3-(1-phenylethoxy)propyl]propanamide IUPAC Name: 3-(4,6-dimethyl-2-methylsulfanylpyrimidin-5-yl)-N-[3-(1-phenylethoxy)propyl]propanamide Traditional Name: 3-[4,6-dimethyl-2-(methylthio)pyrimidin-5-yl]-N-[3-(1-phenylethoxy)propyl]propionamide Formula: C21H29N3O2S MolecularWeight: 387.53886

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)SC)C)CCC(=O)NCCCOC(C)C2=CC=CC=C2

Isomeric SMILES

CC1=C(C(=NC(=N1)SC)C)CCC(=O)NCCCOC(C)C2=CC=CC=C2

InChI

InChI=1S/C21H29N3O2S/c1-15-19(16(2)24-21(23-15)27-4)11-12-20(25)22-13-8-14-26-17(3)18-9-6-5-7-10-18/h5-7,9-10,17H,8,11-14H2,1-4H3,(H,22,25)