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

Systemtic Name: ethyl 3-nitro-5-[(4-propan-2-yl-1,3-thiazol-2-yl)carbamoyl]benzoate Openeye Name: ethyl 3-[(4-isopropylthiazol-2-yl)carbamoyl]-5-nitro-benzoate CAS Name: 3-nitro-5-[oxo-[(4-propan-2-yl-2-thiazolyl)amino]methyl]benzoic acid ethyl ester IUPAC Name: ethyl 3-nitro-5-[(4-propan-2-yl-1,3-thiazol-2-yl)carbamoyl]benzoate Traditional Name: 3-[(4-isopropylthiazol-2-yl)carbamoyl]-5-nitro-benzoic acid ethyl ester Formula: C16H17N3O5S MolecularWeight: 363.38828

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17N3O5S/c1-4-24-15(21)11-5-10(6-12(7-11)19(22)23)14(20)18-16-17-13(8-25-16)9(2)3/h5-9H,4H2,1-3H3,(H,17,18,20)