4-(7-acetamido-3-cyclopropyl-4,5-dihydropyrazolo[4,3-g][1,3]benzothiazol-1-yl)-2-methoxy-benzoic acid

Systemtic Name: 4-(7-acetamido-3-cyclopropyl-4,5-dihydropyrazolo[4,3-g][1,3]benzothiazol-1-yl)-2-methoxy-benzoic acid Openeye Name: 4-(7-acetamido-3-cyclopropyl-4,5-dihydropyrazolo[4,3-g][1,3]benzothiazol-1-yl)-2-methoxy-benzoic acid CAS Name: 4-(7-acetamido-3-cyclopropyl-4,5-dihydropyrazolo[4,3-g][1,3]benzothiazol-1-yl)-2-methoxybenzoic acid IUPAC Name: 4-(7-acetamido-3-cyclopropyl-4,5-dihydropyrazolo[4,3-g][1,3]benzothiazol-1-yl)-2-methoxybenzoic acid Traditional Name: 4-(7-acetamido-3-cyclopropyl-4,5-dihydropyrazolo[4,3-g][1,3]benzothiazol-1-yl)-2-methoxy-benzoic acid Formula: C21H20N4O4S MolecularWeight: 424.4729

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC2=C(S1)C3=C(CC2)C(=NN3C4=CC(=C(C=C4)C(=O)O)OC)C5CC5

Isomeric SMILES

CC(=O)NC1=NC2=C(S1)C3=C(CC2)C(=NN3C4=CC(=C(C=C4)C(=O)O)OC)C5CC5

InChI

InChI=1S/C21H20N4O4S/c1-10(26)22-21-23-15-8-7-14-17(11-3-4-11)24-25(18(14)19(15)30-21)12-5-6-13(20(27)28)16(9-12)29-2/h5-6,9,11H,3-4,7-8H2,1-2H3,(H,27,28)(H,22,23,26)