(4-oxidanylidene-6-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methyl 1H-indazole-3-carboxylate

Systemtic Name: (4-oxidanylidene-6-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methyl 1H-indazole-3-carboxylate Openeye Name: (4-oxo-6-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methyl 1H-indazole-3-carboxylate CAS Name: 1H-indazole-3-carboxylic acid (4-oxo-6-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methyl ester IUPAC Name: (4-oxo-6-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methyl 1H-indazole-3-carboxylate Traditional Name: 1H-indazole-3-carboxylic acid (4-keto-6-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methyl ester Formula: C21H14N4O3S MolecularWeight: 402.42586

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC3=C(S2)N=C(NC3=O)COC(=O)C4=NNC5=CC=CC=C54

Isomeric SMILES

C1=CC=C(C=C1)C2=CC3=C(S2)N=C(NC3=O)COC(=O)C4=NNC5=CC=CC=C54

InChI

InChI=1S/C21H14N4O3S/c26-19-14-10-16(12-6-2-1-3-7-12)29-20(14)23-17(22-19)11-28-21(27)18-13-8-4-5-9-15(13)24-25-18/h1-10H,11H2,(H,24,25)(H,22,23,26)