(2S)-N-[(2-chlorophenyl)methyl]-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-propanamide

Systemtic Name: (2S)-N-[(2-chlorophenyl)methyl]-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-propanamide Openeye Name: (2S)-N-[(2-chlorophenyl)methyl]-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-propanamide CAS Name: (2S)-N-[(2-chlorophenyl)methyl]-2-[(4-methyl-6-phenyl-2-pyrimidinyl)thio]propanamide IUPAC Name: (2S)-N-[(2-chlorophenyl)methyl]-2-(4-methyl-6-phenylpyrimidin-2-yl)sulfanylpropanamide Traditional Name: (2S)-N-(2-chlorobenzyl)-2-[(4-methyl-6-phenyl-pyrimidin-2-yl)thio]propionamide Formula: C21H20ClN3OS MolecularWeight: 397.921

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=C1)C2=CC=CC=C2)SC(C)C(=O)NCC3=CC=CC=C3Cl

Isomeric SMILES

CC1=NC(=NC(=C1)C2=CC=CC=C2)S[C@@H](C)C(=O)NCC3=CC=CC=C3Cl

InChI

InChI=1S/C21H20ClN3OS/c1-14-12-19(16-8-4-3-5-9-16)25-21(24-14)27-15(2)20(26)23-13-17-10-6-7-11-18(17)22/h3-12,15H,13H2,1-2H3,(H,23,26)/t15-/m0/s1