N,N-dipropyl-4-[[4-(quinolin-3-ylamino)pyrimidin-2-yl]amino]benzenesulfonamide

Systemtic Name: N,N-dipropyl-4-[[4-(quinolin-3-ylamino)pyrimidin-2-yl]amino]benzenesulfonamide Openeye Name: N,N-dipropyl-4-[[4-(3-quinolylamino)pyrimidin-2-yl]amino]benzenesulfonamide CAS Name: N,N-dipropyl-4-[[4-(3-quinolinylamino)-2-pyrimidinyl]amino]benzenesulfonamide IUPAC Name: N,N-dipropyl-4-[[4-(quinolin-3-ylamino)pyrimidin-2-yl]amino]benzenesulfonamide Traditional Name: N,N-dipropyl-4-[[4-(3-quinolylamino)pyrimidin-2-yl]amino]benzenesulfonamide Formula: C25H28N6O2S MolecularWeight: 476.59382

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)S(=O)(=O)C1=CC=C(C=C1)NC2=NC=CC(=N2)NC3=CC4=CC=CC=C4N=C3

Isomeric SMILES

CCCN(CCC)S(=O)(=O)C1=CC=C(C=C1)NC2=NC=CC(=N2)NC3=CC4=CC=CC=C4N=C3

InChI

InChI=1S/C25H28N6O2S/c1-3-15-31(16-4-2)34(32,33)22-11-9-20(10-12-22)29-25-26-14-13-24(30-25)28-21-17-19-7-5-6-8-23(19)27-18-21/h5-14,17-18H,3-4,15-16H2,1-2H3,(H2,26,28,29,30)