4-[[5-[(5-methyl-1,2-oxazol-3-yl)carbamoyl]thiophen-3-yl]sulfonylamino]benzoic acid

Systemtic Name: 4-[[5-[(5-methyl-1,2-oxazol-3-yl)carbamoyl]thiophen-3-yl]sulfonylamino]benzoic acid Openeye Name: 4-[[5-[(5-methylisoxazol-3-yl)carbamoyl]-3-thienyl]sulfonylamino]benzoic acid CAS Name: 4-[[5-[[(5-methyl-3-isoxazolyl)amino]-oxomethyl]-3-thiophenyl]sulfonylamino]benzoic acid IUPAC Name: 4-[[5-[(5-methyl-1,2-oxazol-3-yl)carbamoyl]thiophen-3-yl]sulfonylamino]benzoic acid Traditional Name: 4-[[5-[(5-methylisoxazol-3-yl)carbamoyl]-3-thienyl]sulfonylamino]benzoic acid Formula: C16H13N3O6S2 MolecularWeight: 407.42092

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)C2=CC(=CS2)S(=O)(=O)NC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CC1=CC(=NO1)NC(=O)C2=CC(=CS2)S(=O)(=O)NC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C16H13N3O6S2/c1-9-6-14(18-25-9)17-15(20)13-7-12(8-26-13)27(23,24)19-11-4-2-10(3-5-11)16(21)22/h2-8,19H,1H3,(H,21,22)(H,17,18,20)