N-[4-[4-(4-methyl-3-propoxy-phenyl)sulfonylpiperazin-1-yl]sulfonylphenyl]-7-(trifluoromethyl)quinolin-4-amine

Systemtic Name: N-[4-[4-(4-methyl-3-propoxy-phenyl)sulfonylpiperazin-1-yl]sulfonylphenyl]-7-(trifluoromethyl)quinolin-4-amine Openeye Name: N-[4-[4-(4-methyl-3-propoxy-phenyl)sulfonylpiperazin-1-yl]sulfonylphenyl]-7-(trifluoromethyl)quinolin-4-amine CAS Name: N-[4-[[4-(4-methyl-3-propoxyphenyl)sulfonyl-1-piperazinyl]sulfonyl]phenyl]-7-(trifluoromethyl)-4-quinolinamine IUPAC Name: N-[4-[4-(4-methyl-3-propoxyphenyl)sulfonylpiperazin-1-yl]sulfonylphenyl]-7-(trifluoromethyl)quinolin-4-amine Traditional Name: [4-[4-(4-methyl-3-propoxy-phenyl)sulfonylpiperazino]sulfonylphenyl]-[7-(trifluoromethyl)-4-quinolyl]amine Formula: C30H31F3N4O5S2 MolecularWeight: 648.71615

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=CC(=C1)S(=O)(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)NC4=C5C=CC(=CC5=NC=C4)C(F)(F)F)C

Isomeric SMILES

CCCOC1=C(C=CC(=C1)S(=O)(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)NC4=C5C=CC(=CC5=NC=C4)C(F)(F)F)C

InChI

InChI=1S/C30H31F3N4O5S2/c1-3-18-42-29-20-25(8-4-21(29)2)44(40,41)37-16-14-36(15-17-37)43(38,39)24-9-6-23(7-10-24)35-27-12-13-34-28-19-22(30(31,32)33)5-11-26(27)28/h4-13,19-20H,3,14-18H2,1-2H3,(H,34,35)