N-[4-[[4-(2-azanylbenzimidazol-1-yl)pyrimidin-2-yl]amino]phenyl]methanesulfonamide

Systemtic Name: N-[4-[[4-(2-azanylbenzimidazol-1-yl)pyrimidin-2-yl]amino]phenyl]methanesulfonamide Openeye Name: N-[4-[[4-(2-aminobenzimidazol-1-yl)pyrimidin-2-yl]amino]phenyl]methanesulfonamide CAS Name: N-[4-[[4-(2-amino-1-benzimidazolyl)-2-pyrimidinyl]amino]phenyl]methanesulfonamide IUPAC Name: N-[4-[[4-(2-aminobenzimidazol-1-yl)pyrimidin-2-yl]amino]phenyl]methanesulfonamide Traditional Name: N-[4-[[4-(2-aminobenzimidazol-1-yl)pyrimidin-2-yl]amino]phenyl]methanesulfonamide Formula: C18H17N7O2S MolecularWeight: 395.43828

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=CC=C(C=C1)NC2=NC=CC(=N2)N3C4=CC=CC=C4N=C3N

Isomeric SMILES

CS(=O)(=O)NC1=CC=C(C=C1)NC2=NC=CC(=N2)N3C4=CC=CC=C4N=C3N

InChI

InChI=1S/C18H17N7O2S/c1-28(26,27)24-13-8-6-12(7-9-13)21-18-20-11-10-16(23-18)25-15-5-3-2-4-14(15)22-17(25)19/h2-11,24H,1H3,(H2,19,22)(H,20,21,23)