4-oxidanylidene-4-[(3R,7E)-3-thiophen-2-yl-7-(thiophen-2-ylmethylidene)-3,4,5,6-tetrahydro-1H-indazol-2-yl]butanoate

Systemtic Name: 4-oxidanylidene-4-[(3R,7E)-3-thiophen-2-yl-7-(thiophen-2-ylmethylidene)-3,4,5,6-tetrahydro-1H-indazol-2-yl]butanoate Openeye Name: 4-oxo-4-[(3R,7E)-3-(2-thienyl)-7-(2-thienylmethylene)-3,4,5,6-tetrahydro-1H-indazol-2-yl]butanoate CAS Name: 4-oxo-4-[(3R,7E)-3-thiophen-2-yl-7-(thiophen-2-ylmethylidene)-3,4,5,6-tetrahydro-1H-indazol-2-yl]butanoate IUPAC Name: 4-oxo-4-[(3R,7E)-3-thiophen-2-yl-7-(thiophen-2-ylmethylidene)-3,4,5,6-tetrahydro-1H-indazol-2-yl]butanoate Traditional Name: 4-keto-4-[(3R,7E)-7-(2-thenylidene)-3-(2-thienyl)-3,4,5,6-tetrahydro-1H-indazol-2-yl]butyrate Formula: C20H19N2O3S2- MolecularWeight: 399.50646

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=CC2=CC=CS2)C3=C(C1)C(N(N3)C(=O)CCC(=O)[O-])C4=CC=CS4

Isomeric SMILES

C1C/C(=C\C2=CC=CS2)/C3=C(C1)[C@@H](N(N3)C(=O)CCC(=O)[O-])C4=CC=CS4

InChI

InChI=1S/C20H20N2O3S2/c23-17(8-9-18(24)25)22-20(16-7-3-11-27-16)15-6-1-4-13(19(15)21-22)12-14-5-2-10-26-14/h2-3,5,7,10-12,20-21H,1,4,6,8-9H2,(H,24,25)/p-1/b13-12+/t20-/m1/s1