(2S)-2-[1-(2,3-dimethylphenyl)imidazol-2-yl]sulfanyl-N-methyl-N-(phenylmethyl)propanamide

Systemtic Name: (2S)-2-[1-(2,3-dimethylphenyl)imidazol-2-yl]sulfanyl-N-methyl-N-(phenylmethyl)propanamide Openeye Name: (2S)-N-benzyl-2-[1-(2,3-dimethylphenyl)imidazol-2-yl]sulfanyl-N-methyl-propanamide CAS Name: (2S)-2-[[1-(2,3-dimethylphenyl)-2-imidazolyl]thio]-N-methyl-N-(phenylmethyl)propanamide IUPAC Name: (2S)-N-benzyl-2-[1-(2,3-dimethylphenyl)imidazol-2-yl]sulfanyl-N-methylpropanamide Traditional Name: (2S)-N-benzyl-2-[[1-(2,3-dimethylphenyl)imidazol-2-yl]thio]-N-methyl-propionamide Formula: C22H25N3OS MolecularWeight: 379.5184

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2C=CN=C2SC(C)C(=O)N(C)CC3=CC=CC=C3)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2C=CN=C2S[C@@H](C)C(=O)N(C)CC3=CC=CC=C3)C

InChI

InChI=1S/C22H25N3OS/c1-16-9-8-12-20(17(16)2)25-14-13-23-22(25)27-18(3)21(26)24(4)15-19-10-6-5-7-11-19/h5-14,18H,15H2,1-4H3/t18-/m0/s1