N-[1-[2-(1-phenylethylamino)pyrimidin-4-yl]benzimidazol-5-yl]methanesulfonamide

Systemtic Name: N-[1-[2-(1-phenylethylamino)pyrimidin-4-yl]benzimidazol-5-yl]methanesulfonamide Openeye Name: N-[1-[2-(1-phenylethylamino)pyrimidin-4-yl]benzimidazol-5-yl]methanesulfonamide CAS Name: N-[1-[2-(1-phenylethylamino)-4-pyrimidinyl]-5-benzimidazolyl]methanesulfonamide IUPAC Name: N-[1-[2-(1-phenylethylamino)pyrimidin-4-yl]benzimidazol-5-yl]methanesulfonamide Traditional Name: N-[1-[2-(1-phenylethylamino)pyrimidin-4-yl]benzimidazol-5-yl]methanesulfonamide Formula: C20H20N6O2S MolecularWeight: 408.4768

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC2=NC=CC(=N2)N3C=NC4=C3C=CC(=C4)NS(=O)(=O)C

Isomeric SMILES

CC(C1=CC=CC=C1)NC2=NC=CC(=N2)N3C=NC4=C3C=CC(=C4)NS(=O)(=O)C

InChI

InChI=1S/C20H20N6O2S/c1-14(15-6-4-3-5-7-15)23-20-21-11-10-19(24-20)26-13-22-17-12-16(8-9-18(17)26)25-29(2,27)28/h3-14,25H,1-2H3,(H,21,23,24)