7-chloranyl-N-[4-[4-(5-ethoxypyrimidin-2-yl)piperazin-1-yl]sulfonylphenyl]quinolin-4-amine

Systemtic Name: 7-chloranyl-N-[4-[4-(5-ethoxypyrimidin-2-yl)piperazin-1-yl]sulfonylphenyl]quinolin-4-amine Openeye Name: 7-chloro-N-[4-[4-(5-ethoxypyrimidin-2-yl)piperazin-1-yl]sulfonylphenyl]quinolin-4-amine CAS Name: 7-chloro-N-[4-[[4-(5-ethoxy-2-pyrimidinyl)-1-piperazinyl]sulfonyl]phenyl]-4-quinolinamine IUPAC Name: 7-chloro-N-[4-[4-(5-ethoxypyrimidin-2-yl)piperazin-1-yl]sulfonylphenyl]quinolin-4-amine Traditional Name: (7-chloro-4-quinolyl)-[4-[4-(5-ethoxypyrimidin-2-yl)piperazino]sulfonylphenyl]amine Formula: C25H25ClN6O3S MolecularWeight: 525.0224

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CN=C(N=C1)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)NC4=C5C=CC(=CC5=NC=C4)Cl

Isomeric SMILES

CCOC1=CN=C(N=C1)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)NC4=C5C=CC(=CC5=NC=C4)Cl

InChI

InChI=1S/C25H25ClN6O3S/c1-2-35-20-16-28-25(29-17-20)31-11-13-32(14-12-31)36(33,34)21-6-4-19(5-7-21)30-23-9-10-27-24-15-18(26)3-8-22(23)24/h3-10,15-17H,2,11-14H2,1H3,(H,27,30)