3-(4-ethylpiperazin-1-yl)-1-(furan-2-ylmethyl)-4-(3-oxidanylidene-2-phenyl-5-propyl-1H-pyrazol-4-yl)pyrrole-2,5-dione

Systemtic Name: 3-(4-ethylpiperazin-1-yl)-1-(furan-2-ylmethyl)-4-(3-oxidanylidene-2-phenyl-5-propyl-1H-pyrazol-4-yl)pyrrole-2,5-dione Openeye Name: 3-(4-ethylpiperazin-1-yl)-1-(2-furylmethyl)-4-(3-oxo-2-phenyl-5-propyl-1H-pyrazol-4-yl)pyrrole-2,5-dione CAS Name: 3-(4-ethyl-1-piperazinyl)-1-(2-furanylmethyl)-4-(3-oxo-2-phenyl-5-propyl-1H-pyrazol-4-yl)pyrrole-2,5-dione IUPAC Name: 3-(4-ethylpiperazin-1-yl)-1-(furan-2-ylmethyl)-4-(3-oxo-2-phenyl-5-propyl-1H-pyrazol-4-yl)pyrrole-2,5-dione Traditional Name: 3-(4-ethylpiperazino)-1-(2-furfuryl)-4-(5-keto-1-phenyl-3-propyl-3-pyrazolin-4-yl)-3-pyrroline-2,5-quinone Formula: C27H31N5O4 MolecularWeight: 489.56614

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=O)N(N1)C2=CC=CC=C2)C3=C(C(=O)N(C3=O)CC4=CC=CO4)N5CCN(CC5)CC

Isomeric SMILES

CCCC1=C(C(=O)N(N1)C2=CC=CC=C2)C3=C(C(=O)N(C3=O)CC4=CC=CO4)N5CCN(CC5)CC

InChI

InChI=1S/C27H31N5O4/c1-3-9-21-22(26(34)32(28-21)19-10-6-5-7-11-19)23-24(30-15-13-29(4-2)14-16-30)27(35)31(25(23)33)18-20-12-8-17-36-20/h5-8,10-12,17,28H,3-4,9,13-16,18H2,1-2H3