ethyl 3-[[4-(4-methylphenyl)-1,3-thiazol-2-yl]carbamoyl]-5-nitro-benzoate

Systemtic Name: ethyl 3-[[4-(4-methylphenyl)-1,3-thiazol-2-yl]carbamoyl]-5-nitro-benzoate Openeye Name: ethyl 3-nitro-5-[[4-(p-tolyl)thiazol-2-yl]carbamoyl]benzoate CAS Name: 3-[[[4-(4-methylphenyl)-2-thiazolyl]amino]-oxomethyl]-5-nitrobenzoic acid ethyl ester IUPAC Name: ethyl 3-[[4-(4-methylphenyl)-1,3-thiazol-2-yl]carbamoyl]-5-nitrobenzoate Traditional Name: 3-nitro-5-[[4-(p-tolyl)thiazol-2-yl]carbamoyl]benzoic acid ethyl ester Formula: C20H17N3O5S MolecularWeight: 411.43108

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)C(=O)NC2=NC(=CS2)C3=CC=C(C=C3)C)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)C(=O)NC2=NC(=CS2)C3=CC=C(C=C3)C)[N+](=O)[O-]

InChI

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