(4S)-4-ethoxycarbonyl-4-[2-[(4-methylphenyl)amino]-1,3-thiazol-4-yl]hexanoate

Systemtic Name: (4S)-4-ethoxycarbonyl-4-[2-[(4-methylphenyl)amino]-1,3-thiazol-4-yl]hexanoate Openeye Name: (4S)-4-ethoxycarbonyl-4-[2-(4-methylanilino)thiazol-4-yl]hexanoate CAS Name: (4S)-4-ethoxycarbonyl-4-[2-(4-methylanilino)-4-thiazolyl]hexanoate IUPAC Name: (4S)-4-ethoxycarbonyl-4-[2-(4-methylanilino)-1,3-thiazol-4-yl]hexanoate Traditional Name: (4S)-4-carbethoxy-4-[2-(p-toluidino)thiazol-4-yl]hexanoate Formula: C19H23N2O4S- MolecularWeight: 375.46192

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CCC(=O)[O-])(C1=CSC(=N1)NC2=CC=C(C=C2)C)C(=O)OCC

Isomeric SMILES

CC[C@](CCC(=O)[O-])(C1=CSC(=N1)NC2=CC=C(C=C2)C)C(=O)OCC

InChI

InChI=1S/C19H24N2O4S/c1-4-19(11-10-16(22)23,17(24)25-5-2)15-12-26-18(21-15)20-14-8-6-13(3)7-9-14/h6-9,12H,4-5,10-11H2,1-3H3,(H,20,21)(H,22,23)/p-1/t19-/m0/s1