2-[(2E)-2-[3-methyl-5-oxidanylidene-1-(4-phenyl-1,3-thiazol-2-yl)pyrazol-4-ylidene]hydrazinyl]benzoic acid

Systemtic Name: 2-[(2E)-2-[3-methyl-5-oxidanylidene-1-(4-phenyl-1,3-thiazol-2-yl)pyrazol-4-ylidene]hydrazinyl]benzoic acid Openeye Name: 2-[(2E)-2-[3-methyl-5-oxo-1-(4-phenylthiazol-2-yl)pyrazol-4-ylidene]hydrazino]benzoic acid CAS Name: 2-[(2E)-2-[3-methyl-5-oxo-1-(4-phenyl-2-thiazolyl)-4-pyrazolylidene]hydrazinyl]benzoic acid IUPAC Name: 2-[(2E)-2-[3-methyl-5-oxo-1-(4-phenyl-1,3-thiazol-2-yl)pyrazol-4-ylidene]hydrazinyl]benzoic acid Traditional Name: 2-[(N'E)-N'-[5-keto-3-methyl-1-(4-phenylthiazol-2-yl)-2-pyrazolin-4-ylidene]hydrazino]benzoic acid Formula: C20H15N5O3S MolecularWeight: 405.4298

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=NNC2=CC=CC=C2C(=O)O)C3=NC(=CS3)C4=CC=CC=C4

Isomeric SMILES

CC\1=NN(C(=O)/C1=N/NC2=CC=CC=C2C(=O)O)C3=NC(=CS3)C4=CC=CC=C4

InChI

InChI=1S/C20H15N5O3S/c1-12-17(23-22-15-10-6-5-9-14(15)19(27)28)18(26)25(24-12)20-21-16(11-29-20)13-7-3-2-4-8-13/h2-11,22H,1H3,(H,27,28)/b23-17+