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

Systemtic Name: ethyl 3-[[4-(2-methyl-1,3-thiazol-4-yl)phenyl]carbamoyl]-5-nitro-benzoate Openeye Name: ethyl 3-[[4-(2-methylthiazol-4-yl)phenyl]carbamoyl]-5-nitro-benzoate CAS Name: 3-[[4-(2-methyl-4-thiazolyl)anilino]-oxomethyl]-5-nitrobenzoic acid ethyl ester IUPAC Name: ethyl 3-[[4-(2-methyl-1,3-thiazol-4-yl)phenyl]carbamoyl]-5-nitrobenzoate Traditional Name: 3-[[4-(2-methylthiazol-4-yl)phenyl]carbamoyl]-5-nitro-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=CC=C(C=C2)C3=CSC(=N3)C)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)C(=O)NC2=CC=C(C=C2)C3=CSC(=N3)C)[N+](=O)[O-]

InChI

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