3-ethoxycarbonyl-1-phenyl-4H-thiochromeno[4,3-c]pyrazole-8-carboxylic acid

Systemtic Name: 3-ethoxycarbonyl-1-phenyl-4H-thiochromeno[4,3-c]pyrazole-8-carboxylic acid Openeye Name: 3-ethoxycarbonyl-1-phenyl-4H-thiochromeno[4,3-c]pyrazole-8-carboxylic acid CAS Name: 3-ethoxycarbonyl-1-phenyl-4H-thiochromeno[4,3-c]pyrazole-8-carboxylic acid IUPAC Name: 3-ethoxycarbonyl-1-phenyl-4H-thiochromeno[4,3-c]pyrazole-8-carboxylic acid Traditional Name: 3-carbethoxy-1-phenyl-4H-thiochromeno[4,3-c]pyrazole-8-carboxylic acid Formula: C20H16N2O4S MolecularWeight: 380.41704

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C2=C1CSC3=C2C=C(C=C3)C(=O)O)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=NN(C2=C1CSC3=C2C=C(C=C3)C(=O)O)C4=CC=CC=C4

InChI

InChI=1S/C20H16N2O4S/c1-2-26-20(25)17-15-11-27-16-9-8-12(19(23)24)10-14(16)18(15)22(21-17)13-6-4-3-5-7-13/h3-10H,2,11H2,1H3,(H,23,24)