6-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]-4-[5-(4-methylpiperazin-1-yl)sulfonylthiophen-2-yl]quinazoline

Systemtic Name: 6-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]-4-[5-(4-methylpiperazin-1-yl)sulfonylthiophen-2-yl]quinazoline Openeye Name: 6-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]-4-[5-(4-methylpiperazin-1-yl)sulfonyl-2-thienyl]quinazoline CAS Name: 6-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]-4-[5-[(4-methyl-1-piperazinyl)sulfonyl]-2-thiophenyl]quinazoline IUPAC Name: 6-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]-4-[5-(4-methylpiperazin-1-yl)sulfonylthiophen-2-yl]quinazoline Traditional Name: 6-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]-4-[5-(4-methylpiperazino)sulfonyl-2-thienyl]quinazoline Formula: C26H23FN6O2S2 MolecularWeight: 534.628223

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)S(=O)(=O)C2=CC=C(S2)C3=NC=NC4=C3C=C(C=C4)C5=C(NN=C5)C6=CC=C(C=C6)F

Isomeric SMILES

CN1CCN(CC1)S(=O)(=O)C2=CC=C(S2)C3=NC=NC4=C3C=C(C=C4)C5=C(NN=C5)C6=CC=C(C=C6)F

InChI

InChI=1S/C26H23FN6O2S2/c1-32-10-12-33(13-11-32)37(34,35)24-9-8-23(36-24)26-20-14-18(4-7-22(20)28-16-29-26)21-15-30-31-25(21)17-2-5-19(27)6-3-17/h2-9,14-16H,10-13H2,1H3,(H,30,31)