ethyl 2-[2-[(1R)-1-cyano-2-(4-methylphenyl)ethyl]sulfanyl-1,3-thiazol-4-yl]ethanoate

Systemtic Name: ethyl 2-[2-[(1R)-1-cyano-2-(4-methylphenyl)ethyl]sulfanyl-1,3-thiazol-4-yl]ethanoate Openeye Name: ethyl 2-[2-[(1R)-1-cyano-2-(p-tolyl)ethyl]sulfanylthiazol-4-yl]acetate CAS Name: 2-[2-[[(1R)-1-cyano-2-(4-methylphenyl)ethyl]thio]-4-thiazolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-[(1R)-1-cyano-2-(4-methylphenyl)ethyl]sulfanyl-1,3-thiazol-4-yl]acetate Traditional Name: 2-[2-[[(1R)-1-cyano-2-(p-tolyl)ethyl]thio]thiazol-4-yl]acetic acid ethyl ester Formula: C17H18N2O2S2 MolecularWeight: 346.46702

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=CSC(=N1)SC(CC2=CC=C(C=C2)C)C#N

Isomeric SMILES

CCOC(=O)CC1=CSC(=N1)S[C@H](CC2=CC=C(C=C2)C)C#N

InChI

InChI=1S/C17H18N2O2S2/c1-3-21-16(20)9-14-11-22-17(19-14)23-15(10-18)8-13-6-4-12(2)5-7-13/h4-7,11,15H,3,8-9H2,1-2H3/t15-/m1/s1