(2S)-N-[(3,4-dimethoxyphenyl)methyl]-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-propanamide

Systemtic Name: (2S)-N-[(3,4-dimethoxyphenyl)methyl]-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-propanamide Openeye Name: (2S)-N-[(3,4-dimethoxyphenyl)methyl]-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-propanamide CAS Name: (2S)-N-[(3,4-dimethoxyphenyl)methyl]-2-[(4-methyl-6-phenyl-2-pyrimidinyl)thio]propanamide IUPAC Name: (2S)-N-[(3,4-dimethoxyphenyl)methyl]-2-(4-methyl-6-phenylpyrimidin-2-yl)sulfanylpropanamide Traditional Name: (2S)-2-[(4-methyl-6-phenyl-pyrimidin-2-yl)thio]-N-veratryl-propionamide Formula: C23H25N3O3S MolecularWeight: 423.5279

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=C1)C2=CC=CC=C2)SC(C)C(=O)NCC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC1=NC(=NC(=C1)C2=CC=CC=C2)S[C@@H](C)C(=O)NCC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C23H25N3O3S/c1-15-12-19(18-8-6-5-7-9-18)26-23(25-15)30-16(2)22(27)24-14-17-10-11-20(28-3)21(13-17)29-4/h5-13,16H,14H2,1-4H3,(H,24,27)/t16-/m0/s1