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

Systemtic Name: 3-[[4-(quinolin-3-ylamino)pyrimidin-2-yl]amino]benzenesulfonamide Openeye Name: 3-[[4-(3-quinolylamino)pyrimidin-2-yl]amino]benzenesulfonamide CAS Name: 3-[[4-(3-quinolinylamino)-2-pyrimidinyl]amino]benzenesulfonamide IUPAC Name: 3-[[4-(quinolin-3-ylamino)pyrimidin-2-yl]amino]benzenesulfonamide Traditional Name: 3-[[4-(3-quinolylamino)pyrimidin-2-yl]amino]benzenesulfonamide Formula: C19H16N6O2S MolecularWeight: 392.43434

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(C=N2)NC3=NC(=NC=C3)NC4=CC(=CC=C4)S(=O)(=O)N

Isomeric SMILES

C1=CC=C2C(=C1)C=C(C=N2)NC3=NC(=NC=C3)NC4=CC(=CC=C4)S(=O)(=O)N

InChI

InChI=1S/C19H16N6O2S/c20-28(26,27)16-6-3-5-14(11-16)24-19-21-9-8-18(25-19)23-15-10-13-4-1-2-7-17(13)22-12-15/h1-12H,(H2,20,26,27)(H2,21,23,24,25)