(2R)-N-(4-bromophenyl)-2-(4,5,6-trimethylpyrimidin-2-yl)sulfanyl-propanamide

Systemtic Name: (2R)-N-(4-bromophenyl)-2-(4,5,6-trimethylpyrimidin-2-yl)sulfanyl-propanamide Openeye Name: (2R)-N-(4-bromophenyl)-2-(4,5,6-trimethylpyrimidin-2-yl)sulfanyl-propanamide CAS Name: (2R)-N-(4-bromophenyl)-2-[(4,5,6-trimethyl-2-pyrimidinyl)thio]propanamide IUPAC Name: (2R)-N-(4-bromophenyl)-2-(4,5,6-trimethylpyrimidin-2-yl)sulfanylpropanamide Traditional Name: (2R)-N-(4-bromophenyl)-2-[(4,5,6-trimethylpyrimidin-2-yl)thio]propionamide Formula: C16H18BrN3OS MolecularWeight: 380.30262

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N=C1C)SC(C)C(=O)NC2=CC=C(C=C2)Br)C

Isomeric SMILES

CC1=C(N=C(N=C1C)S[C@H](C)C(=O)NC2=CC=C(C=C2)Br)C

InChI

InChI=1S/C16H18BrN3OS/c1-9-10(2)18-16(19-11(9)3)22-12(4)15(21)20-14-7-5-13(17)6-8-14/h5-8,12H,1-4H3,(H,20,21)/t12-/m1/s1