4-piperidin-1-yl-2-[1-[4-[4-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]ethyl]quinazoline

Systemtic Name: 4-piperidin-1-yl-2-[1-[4-[4-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]ethyl]quinazoline Openeye Name: 4-(1-piperidyl)-2-[1-[4-[4-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]ethyl]quinazoline CAS Name: 4-(1-piperidinyl)-2-[1-[4-[4-(trifluoromethyl)phenyl]sulfonyl-1-piperazinyl]ethyl]quinazoline IUPAC Name: 4-piperidin-1-yl-2-[1-[4-[4-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]ethyl]quinazoline Traditional Name: 4-piperidino-2-[1-[4-[4-(trifluoromethyl)phenyl]sulfonylpiperazino]ethyl]quinazoline Formula: C26H30F3N5O2S MolecularWeight: 533.60891

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC2=CC=CC=C2C(=N1)N3CCCCC3)N4CCN(CC4)S(=O)(=O)C5=CC=C(C=C5)C(F)(F)F

Isomeric SMILES

CC(C1=NC2=CC=CC=C2C(=N1)N3CCCCC3)N4CCN(CC4)S(=O)(=O)C5=CC=C(C=C5)C(F)(F)F

InChI

InChI=1S/C26H30F3N5O2S/c1-19(24-30-23-8-4-3-7-22(23)25(31-24)33-13-5-2-6-14-33)32-15-17-34(18-16-32)37(35,36)21-11-9-20(10-12-21)26(27,28)29/h3-4,7-12,19H,2,5-6,13-18H2,1H3