(7-acetamido-2-oxidanylidene-chromen-4-yl)methyl 1,3-dimethylthieno[2,3-c]pyrazole-5-carboxylate

Systemtic Name: (7-acetamido-2-oxidanylidene-chromen-4-yl)methyl 1,3-dimethylthieno[2,3-c]pyrazole-5-carboxylate Openeye Name: (7-acetamido-2-oxo-chromen-4-yl)methyl 1,3-dimethylthieno[2,3-c]pyrazole-5-carboxylate CAS Name: 1,3-dimethyl-5-thieno[2,3-c]pyrazolecarboxylic acid (7-acetamido-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-acetamido-2-oxochromen-4-yl)methyl 1,3-dimethylthieno[2,3-c]pyrazole-5-carboxylate Traditional Name: 1,3-dimethylthieno[2,3-c]pyrazole-5-carboxylic acid (7-acetamido-2-keto-chromen-4-yl)methyl ester Formula: C20H17N3O5S MolecularWeight: 411.43108

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C=C(S2)C(=O)OCC3=CC(=O)OC4=C3C=CC(=C4)NC(=O)C)C

Isomeric SMILES

CC1=NN(C2=C1C=C(S2)C(=O)OCC3=CC(=O)OC4=C3C=CC(=C4)NC(=O)C)C

InChI

InChI=1S/C20H17N3O5S/c1-10-15-8-17(29-19(15)23(3)22-10)20(26)27-9-12-6-18(25)28-16-7-13(21-11(2)24)4-5-14(12)16/h4-8H,9H2,1-3H3,(H,21,24)