N-cyclopropyl-3-[[5-methyl-4-[[4-(pyridin-3-ylmethyl)phenyl]amino]pyrimidin-2-yl]amino]benzenesulfonamide

Systemtic Name: N-cyclopropyl-3-[[5-methyl-4-[[4-(pyridin-3-ylmethyl)phenyl]amino]pyrimidin-2-yl]amino]benzenesulfonamide Openeye Name: N-cyclopropyl-3-[[5-methyl-4-[4-(3-pyridylmethyl)anilino]pyrimidin-2-yl]amino]benzenesulfonamide CAS Name: N-cyclopropyl-3-[[5-methyl-4-[4-(3-pyridinylmethyl)anilino]-2-pyrimidinyl]amino]benzenesulfonamide IUPAC Name: N-cyclopropyl-3-[[5-methyl-4-[4-(pyridin-3-ylmethyl)anilino]pyrimidin-2-yl]amino]benzenesulfonamide Traditional Name: N-cyclopropyl-3-[[5-methyl-4-[4-(3-pyridylmethyl)anilino]pyrimidin-2-yl]amino]benzenesulfonamide Formula: C26H26N6O2S MolecularWeight: 486.58864

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(N=C1NC2=CC=C(C=C2)CC3=CN=CC=C3)NC4=CC(=CC=C4)S(=O)(=O)NC5CC5

Isomeric SMILES

CC1=CN=C(N=C1NC2=CC=C(C=C2)CC3=CN=CC=C3)NC4=CC(=CC=C4)S(=O)(=O)NC5CC5

InChI

InChI=1S/C26H26N6O2S/c1-18-16-28-26(30-23-5-2-6-24(15-23)35(33,34)32-22-11-12-22)31-25(18)29-21-9-7-19(8-10-21)14-20-4-3-13-27-17-20/h2-10,13,15-17,22,32H,11-12,14H2,1H3,(H2,28,29,30,31)