ethyl 2-[(3-ethylsulfanylphenyl)carbonylamino]-4-phenyl-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 2-[(3-ethylsulfanylphenyl)carbonylamino]-4-phenyl-1,3-thiazole-5-carboxylate Openeye Name: ethyl 2-[(3-ethylsulfanylbenzoyl)amino]-4-phenyl-thiazole-5-carboxylate CAS Name: 2-[[[3-(ethylthio)phenyl]-oxomethyl]amino]-4-phenyl-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(3-ethylsulfanylbenzoyl)amino]-4-phenyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[[3-(ethylthio)benzoyl]amino]-4-phenyl-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)C2=CC(=CC=C2)SCC)C3=CC=CC=C3

Isomeric SMILES

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

InChI

InChI=1S/C21H20N2O3S2/c1-3-26-20(25)18-17(14-9-6-5-7-10-14)22-21(28-18)23-19(24)15-11-8-12-16(13-15)27-4-2/h5-13H,3-4H2,1-2H3,(H,22,23,24)