methyl (3aS,6aR)-1-phenyl-3-thiophen-3-yl-4,6a-dihydro-3aH-pyrrolo[2,3-c]pyrazole-5-carboxylate

Systemtic Name: methyl (3aS,6aR)-1-phenyl-3-thiophen-3-yl-4,6a-dihydro-3aH-pyrrolo[2,3-c]pyrazole-5-carboxylate Openeye Name: methyl (3aS,6aR)-1-phenyl-3-(3-thienyl)-4,6a-dihydro-3aH-pyrrolo[2,3-c]pyrazole-5-carboxylate CAS Name: (3aS,6aR)-1-phenyl-3-(3-thiophenyl)-4,6a-dihydro-3aH-pyrrolo[2,3-c]pyrazole-5-carboxylic acid methyl ester IUPAC Name: methyl (3aS,6aR)-1-phenyl-3-thiophen-3-yl-4,6a-dihydro-3aH-pyrrolo[2,3-c]pyrazole-5-carboxylate Traditional Name: (3aS,6aR)-1-phenyl-3-(3-thienyl)-4,6a-dihydro-3aH-pyrrolo[2,3-c]pyrazole-5-carboxylic acid methyl ester Formula: C17H15N3O2S MolecularWeight: 325.3849

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=NC2C(C1)C(=NN2C3=CC=CC=C3)C4=CSC=C4

Isomeric SMILES

COC(=O)C1=N[C@H]2[C@H](C1)C(=NN2C3=CC=CC=C3)C4=CSC=C4

InChI

InChI=1S/C17H15N3O2S/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/h2-8,10,13,16H,9H2,1H3/t13-,16-/m1/s1