ethyl 4-methyl-2-[[(2S)-2-phenyl-2-phenylsulfanyl-ethanoyl]amino]-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 4-methyl-2-[[(2S)-2-phenyl-2-phenylsulfanyl-ethanoyl]amino]-1,3-thiazole-5-carboxylate Openeye Name: ethyl 4-methyl-2-[[(2S)-2-phenyl-2-phenylsulfanyl-acetyl]amino]thiazole-5-carboxylate CAS Name: 4-methyl-2-[[(2S)-1-oxo-2-phenyl-2-(phenylthio)ethyl]amino]-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-2-[[(2S)-2-phenyl-2-phenylsulfanylacetyl]amino]-1,3-thiazole-5-carboxylate Traditional Name: 4-methyl-2-[[(2S)-2-phenyl-2-(phenylthio)acetyl]amino]thiazole-5-carboxylic acid ethyl ester Formula: C21H20N2O3S2 MolecularWeight: 412.5251

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(S1)NC(=O)C(C2=CC=CC=C2)SC3=CC=CC=C3)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)NC(=O)[C@H](C2=CC=CC=C2)SC3=CC=CC=C3)C

InChI

InChI=1S/C21H20N2O3S2/c1-3-26-20(25)17-14(2)22-21(28-17)23-19(24)18(15-10-6-4-7-11-15)27-16-12-8-5-9-13-16/h4-13,18H,3H2,1-2H3,(H,22,23,24)/t18-/m0/s1