methyl 1-phenyl-3-thiophen-3-yl-2H-pyrrolo[2,3-c]pyrazole-5-carboxylate

Systemtic Name: methyl 1-phenyl-3-thiophen-3-yl-2H-pyrrolo[2,3-c]pyrazole-5-carboxylate Openeye Name: methyl 1-phenyl-3-(3-thienyl)-2H-pyrrolo[2,3-c]pyrazole-5-carboxylate CAS Name: 1-phenyl-3-(3-thiophenyl)-2H-pyrrolo[2,3-c]pyrazole-5-carboxylic acid methyl ester IUPAC Name: methyl 1-phenyl-3-thiophen-3-yl-2H-pyrrolo[2,3-c]pyrazole-5-carboxylate Traditional Name: 1-phenyl-3-(3-thienyl)-2H-pyrrolo[2,3-c]pyrazole-5-carboxylic acid methyl ester Formula: C17H13N3O2S MolecularWeight: 323.36902

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(NN(C2=N1)C3=CC=CC=C3)C4=CSC=C4

Isomeric SMILES

COC(=O)C1=CC2=C(NN(C2=N1)C3=CC=CC=C3)C4=CSC=C4

InChI

InChI=1S/C17H13N3O2S/c1-22-17(21)14-9-13-15(11-7-8-23-10-11)19-20(16(13)18-14)12-5-3-2-4-6-12/h2-10,19H,1H3