ethyl 2-[(4-methoxyphenyl)-(3-nitrophenyl)carbonyl-amino]-4-methyl-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 2-[(4-methoxyphenyl)-(3-nitrophenyl)carbonyl-amino]-4-methyl-1,3-thiazole-5-carboxylate Openeye Name: ethyl 2-(4-methoxy-N-(3-nitrobenzoyl)anilino)-4-methyl-thiazole-5-carboxylate CAS Name: 2-(4-methoxy-N-[(3-nitrophenyl)-oxomethyl]anilino)-4-methyl-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(4-methoxy-N-(3-nitrobenzoyl)anilino)-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-(4-methoxy-N-(3-nitrobenzoyl)anilino)-4-methyl-thiazole-5-carboxylic acid ethyl ester Formula: C21H19N3O6S MolecularWeight: 441.45706

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H19N3O6S/c1-4-30-20(26)18-13(2)22-21(31-18)23(15-8-10-17(29-3)11-9-15)19(25)14-6-5-7-16(12-14)24(27)28/h5-12H,4H2,1-3H3