[4-[1-(4-ethylphenyl)-5-pyrrol-1-yl-pyrazol-4-yl]carbonylpiperazin-1-yl]-(furan-2-yl)methanone

Systemtic Name: [4-[1-(4-ethylphenyl)-5-pyrrol-1-yl-pyrazol-4-yl]carbonylpiperazin-1-yl]-(furan-2-yl)methanone Openeye Name: [4-[1-(4-ethylphenyl)-5-pyrrol-1-yl-pyrazole-4-carbonyl]piperazin-1-yl]-(2-furyl)methanone CAS Name: [4-[[1-(4-ethylphenyl)-5-(1-pyrrolyl)-4-pyrazolyl]-oxomethyl]-1-piperazinyl]-(2-furanyl)methanone IUPAC Name: [4-[1-(4-ethylphenyl)-5-pyrrol-1-ylpyrazole-4-carbonyl]piperazin-1-yl]-(furan-2-yl)methanone Traditional Name: [4-[1-(4-ethylphenyl)-5-pyrrol-1-yl-pyrazole-4-carbonyl]piperazino]-(2-furyl)methanone Formula: C25H25N5O3 MolecularWeight: 443.4977

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2C(=C(C=N2)C(=O)N3CCN(CC3)C(=O)C4=CC=CO4)N5C=CC=C5

Isomeric SMILES

CCC1=CC=C(C=C1)N2C(=C(C=N2)C(=O)N3CCN(CC3)C(=O)C4=CC=CO4)N5C=CC=C5

InChI

InChI=1S/C25H25N5O3/c1-2-19-7-9-20(10-8-19)30-23(27-11-3-4-12-27)21(18-26-30)24(31)28-13-15-29(16-14-28)25(32)22-6-5-17-33-22/h3-12,17-18H,2,13-16H2,1H3