(2S)-N-(2-methyl-1,3-benzoxazol-5-yl)-2-(4-methylphenyl)sulfanyl-propanamide

Systemtic Name: (2S)-N-(2-methyl-1,3-benzoxazol-5-yl)-2-(4-methylphenyl)sulfanyl-propanamide Openeye Name: (2S)-N-(2-methyl-1,3-benzoxazol-5-yl)-2-(p-tolylsulfanyl)propanamide CAS Name: (2S)-N-(2-methyl-1,3-benzoxazol-5-yl)-2-[(4-methylphenyl)thio]propanamide IUPAC Name: (2S)-N-(2-methyl-1,3-benzoxazol-5-yl)-2-(4-methylphenyl)sulfanylpropanamide Traditional Name: (2S)-N-(2-methyl-1,3-benzoxazol-5-yl)-2-(p-tolylthio)propionamide Formula: C18H18N2O2S MolecularWeight: 326.41272

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC(C)C(=O)NC2=CC3=C(C=C2)OC(=N3)C

Isomeric SMILES

CC1=CC=C(C=C1)S[C@@H](C)C(=O)NC2=CC3=C(C=C2)OC(=N3)C

InChI

InChI=1S/C18H18N2O2S/c1-11-4-7-15(8-5-11)23-12(2)18(21)20-14-6-9-17-16(10-14)19-13(3)22-17/h4-10,12H,1-3H3,(H,20,21)/t12-/m0/s1