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

Systemtic Name: ethyl 2-[(4-chloranyl-3-nitro-phenyl)carbonyl-cyclopentyl-amino]-4-methyl-1,3-thiazole-5-carboxylate Openeye Name: ethyl 2-[(4-chloro-3-nitro-benzoyl)-cyclopentyl-amino]-4-methyl-thiazole-5-carboxylate CAS Name: 2-[[(4-chloro-3-nitrophenyl)-oxomethyl]-cyclopentylamino]-4-methyl-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(4-chloro-3-nitrobenzoyl)-cyclopentylamino]-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[(4-chloro-3-nitro-benzoyl)-cyclopentyl-amino]-4-methyl-thiazole-5-carboxylic acid ethyl ester Formula: C19H20ClN3O5S MolecularWeight: 437.8972

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(S1)N(C2CCCC2)C(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)N(C2CCCC2)C(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])C

InChI

InChI=1S/C19H20ClN3O5S/c1-3-28-18(25)16-11(2)21-19(29-16)22(13-6-4-5-7-13)17(24)12-8-9-14(20)15(10-12)23(26)27/h8-10,13H,3-7H2,1-2H3