(2S)-N-[4-(4-ethylphenyl)-1,3-thiazol-2-yl]-2-(phenylmethylsulfanyl)propanamide

Systemtic Name: (2S)-N-[4-(4-ethylphenyl)-1,3-thiazol-2-yl]-2-(phenylmethylsulfanyl)propanamide Openeye Name: (2S)-2-benzylsulfanyl-N-[4-(4-ethylphenyl)thiazol-2-yl]propanamide CAS Name: (2S)-N-[4-(4-ethylphenyl)-2-thiazolyl]-2-(phenylmethylthio)propanamide IUPAC Name: (2S)-2-benzylsulfanyl-N-[4-(4-ethylphenyl)-1,3-thiazol-2-yl]propanamide Traditional Name: (2S)-2-(benzylthio)-N-[4-(4-ethylphenyl)thiazol-2-yl]propionamide Formula: C21H22N2OS2 MolecularWeight: 382.54218

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C(C)SCC3=CC=CC=C3

Isomeric SMILES

CCC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)[C@H](C)SCC3=CC=CC=C3

InChI

InChI=1S/C21H22N2OS2/c1-3-16-9-11-18(12-10-16)19-14-26-21(22-19)23-20(24)15(2)25-13-17-7-5-4-6-8-17/h4-12,14-15H,3,13H2,1-2H3,(H,22,23,24)/t15-/m0/s1