ethyl 2-[(4-chloranyl-3-nitro-phenyl)carbonyl-cyclopropyl-amino]-4-methyl-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 2-[(4-chloranyl-3-nitro-phenyl)carbonyl-cyclopropyl-amino]-4-methyl-1,3-thiazole-5-carboxylate Openeye Name: ethyl 2-[(4-chloro-3-nitro-benzoyl)-cyclopropyl-amino]-4-methyl-thiazole-5-carboxylate CAS Name: 2-[[(4-chloro-3-nitrophenyl)-oxomethyl]-cyclopropylamino]-4-methyl-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(4-chloro-3-nitrobenzoyl)-cyclopropylamino]-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[(4-chloro-3-nitro-benzoyl)-cyclopropyl-amino]-4-methyl-thiazole-5-carboxylic acid ethyl ester Formula: C17H16ClN3O5S MolecularWeight: 409.84404

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(S1)N(C2CC2)C(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)N(C2CC2)C(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])C

InChI

InChI=1S/C17H16ClN3O5S/c1-3-26-16(23)14-9(2)19-17(27-14)20(11-5-6-11)15(22)10-4-7-12(18)13(8-10)21(24)25/h4,7-8,11H,3,5-6H2,1-2H3