2-[[5-methyl-4-(4-phenylphenyl)-1,3-thiazol-2-yl]carbamoyl]-6-nitro-benzoic acid

Systemtic Name: 2-[[5-methyl-4-(4-phenylphenyl)-1,3-thiazol-2-yl]carbamoyl]-6-nitro-benzoic acid Openeye Name: 2-[[5-methyl-4-(4-phenylphenyl)thiazol-2-yl]carbamoyl]-6-nitro-benzoic acid CAS Name: 2-[[[5-methyl-4-(4-phenylphenyl)-2-thiazolyl]amino]-oxomethyl]-6-nitrobenzoic acid IUPAC Name: 2-[[5-methyl-4-(4-phenylphenyl)-1,3-thiazol-2-yl]carbamoyl]-6-nitrobenzoic acid Traditional Name: 2-[[5-methyl-4-(4-phenylphenyl)thiazol-2-yl]carbamoyl]-6-nitro-benzoic acid Formula: C24H17N3O5S MolecularWeight: 459.47388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(S1)NC(=O)C2=C(C(=CC=C2)[N+](=O)[O-])C(=O)O)C3=CC=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=C(N=C(S1)NC(=O)C2=C(C(=CC=C2)[N+](=O)[O-])C(=O)O)C3=CC=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C24H17N3O5S/c1-14-21(17-12-10-16(11-13-17)15-6-3-2-4-7-15)25-24(33-14)26-22(28)18-8-5-9-19(27(31)32)20(18)23(29)30/h2-13H,1H3,(H,29,30)(H,25,26,28)