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

Systemtic Name: N-[1-(2-bromophenyl)ethyl]-3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)propanamide Openeye Name: N-[1-(2-bromophenyl)ethyl]-3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)propanamide CAS Name: N-[1-(2-bromophenyl)ethyl]-3-[4,6-dimethyl-2-(methylthio)-5-pyrimidinyl]propanamide IUPAC Name: N-[1-(2-bromophenyl)ethyl]-3-(4,6-dimethyl-2-methylsulfanylpyrimidin-5-yl)propanamide Traditional Name: N-[1-(2-bromophenyl)ethyl]-3-[4,6-dimethyl-2-(methylthio)pyrimidin-5-yl]propionamide Formula: C18H22BrN3OS MolecularWeight: 408.35578

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)SC)C)CCC(=O)NC(C)C2=CC=CC=C2Br

Isomeric SMILES

CC1=C(C(=NC(=N1)SC)C)CCC(=O)NC(C)C2=CC=CC=C2Br

InChI

InChI=1S/C18H22BrN3OS/c1-11-14(12(2)22-18(21-11)24-4)9-10-17(23)20-13(3)15-7-5-6-8-16(15)19/h5-8,13H,9-10H2,1-4H3,(H,20,23)