ethyl 2-[2-(4-methylphenyl)sulfanylethanoylamino]-4-phenyl-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 2-[2-(4-methylphenyl)sulfanylethanoylamino]-4-phenyl-1,3-thiazole-5-carboxylate Openeye Name: ethyl 4-phenyl-2-[[2-(p-tolylsulfanyl)acetyl]amino]thiazole-5-carboxylate CAS Name: 2-[[2-[(4-methylphenyl)thio]-1-oxoethyl]amino]-4-phenyl-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(4-methylphenyl)sulfanylacetyl]amino]-4-phenyl-1,3-thiazole-5-carboxylate Traditional Name: 4-phenyl-2-[[2-(p-tolylthio)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)CSC2=CC=C(C=C2)C)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)NC(=O)CSC2=CC=C(C=C2)C)C3=CC=CC=C3

InChI

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