3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)-N-(3-methyl-2-phenyl-butyl)propanamide

Systemtic Name: 3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)-N-(3-methyl-2-phenyl-butyl)propanamide Openeye Name: 3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)-N-(3-methyl-2-phenyl-butyl)propanamide CAS Name: 3-[4,6-dimethyl-2-(methylthio)-5-pyrimidinyl]-N-(3-methyl-2-phenylbutyl)propanamide IUPAC Name: 3-(4,6-dimethyl-2-methylsulfanylpyrimidin-5-yl)-N-(3-methyl-2-phenylbutyl)propanamide Traditional Name: 3-[4,6-dimethyl-2-(methylthio)pyrimidin-5-yl]-N-(3-methyl-2-phenyl-butyl)propionamide Formula: C21H29N3OS MolecularWeight: 371.53946

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H29N3OS/c1-14(2)19(17-9-7-6-8-10-17)13-22-20(25)12-11-18-15(3)23-21(26-5)24-16(18)4/h6-10,14,19H,11-13H2,1-5H3,(H,22,25)