1-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]-4-[5-(4-methylpiperazin-1-yl)sulfonylthiophen-2-yl]-4H-quinazoline

Systemtic Name: 1-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]-4-[5-(4-methylpiperazin-1-yl)sulfonylthiophen-2-yl]-4H-quinazoline Openeye Name: 1-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]-4-[5-(4-methylpiperazin-1-yl)sulfonyl-2-thienyl]-4H-quinazoline CAS Name: 1-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]-4-[5-[(4-methyl-1-piperazinyl)sulfonyl]-2-thiophenyl]-4H-quinazoline IUPAC Name: 1-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]-4-[5-(4-methylpiperazin-1-yl)sulfonylthiophen-2-yl]-4H-quinazoline Traditional Name: 1-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]-4-[5-(4-methylpiperazino)sulfonyl-2-thienyl]-4H-quinazoline Formula: C26H25FN6O2S2 MolecularWeight: 536.644103

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)S(=O)(=O)C2=CC=C(S2)C3C4=CC=CC=C4N(C=N3)C5=C(NN=C5)C6=CC=C(C=C6)F

Isomeric SMILES

CN1CCN(CC1)S(=O)(=O)C2=CC=C(S2)C3C4=CC=CC=C4N(C=N3)C5=C(NN=C5)C6=CC=C(C=C6)F

InChI

InChI=1S/C26H25FN6O2S2/c1-31-12-14-32(15-13-31)37(34,35)24-11-10-23(36-24)26-20-4-2-3-5-21(20)33(17-28-26)22-16-29-30-25(22)18-6-8-19(27)9-7-18/h2-11,16-17,26H,12-15H2,1H3,(H,29,30)