[2-oxidanylidene-2-[[phenyl(thiophen-2-yl)methyl]amino]ethyl] 1H-indazole-3-carboxylate

Systemtic Name: [2-oxidanylidene-2-[[phenyl(thiophen-2-yl)methyl]amino]ethyl] 1H-indazole-3-carboxylate Openeye Name: [2-oxo-2-[[phenyl(2-thienyl)methyl]amino]ethyl] 1H-indazole-3-carboxylate CAS Name: 1H-indazole-3-carboxylic acid [2-oxo-2-[[phenyl(thiophen-2-yl)methyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-[[phenyl(thiophen-2-yl)methyl]amino]ethyl] 1H-indazole-3-carboxylate Traditional Name: 1H-indazole-3-carboxylic acid [2-keto-2-[[phenyl(2-thienyl)methyl]amino]ethyl] ester Formula: C21H17N3O3S MolecularWeight: 391.44298

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CS2)NC(=O)COC(=O)C3=NNC4=CC=CC=C43

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CS2)NC(=O)COC(=O)C3=NNC4=CC=CC=C43

InChI

InChI=1S/C21H17N3O3S/c25-18(13-27-21(26)20-15-9-4-5-10-16(15)23-24-20)22-19(17-11-6-12-28-17)14-7-2-1-3-8-14/h1-12,19H,13H2,(H,22,25)(H,23,24)