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

Systemtic Name: ethyl 2-[(3-methyl-2-nitro-phenyl)carbonylamino]-4-phenyl-1,3-thiazole-5-carboxylate Openeye Name: ethyl 2-[(3-methyl-2-nitro-benzoyl)amino]-4-phenyl-thiazole-5-carboxylate CAS Name: 2-[[(3-methyl-2-nitrophenyl)-oxomethyl]amino]-4-phenyl-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(3-methyl-2-nitrobenzoyl)amino]-4-phenyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[(3-methyl-2-nitro-benzoyl)amino]-4-phenyl-thiazole-5-carboxylic acid ethyl ester Formula: C20H17N3O5S MolecularWeight: 411.43108

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(S1)NC(=O)C2=C(C(=CC=C2)C)[N+](=O)[O-])C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)NC(=O)C2=C(C(=CC=C2)C)[N+](=O)[O-])C3=CC=CC=C3

InChI

InChI=1S/C20H17N3O5S/c1-3-28-19(25)17-15(13-9-5-4-6-10-13)21-20(29-17)22-18(24)14-11-7-8-12(2)16(14)23(26)27/h4-11H,3H2,1-2H3,(H,21,22,24)