(E)-N-[6-chloranyl-2-cyclopropyl-5-(4-methylphenyl)pyrimidin-4-yl]-2-phenyl-ethenesulfonamide

Systemtic Name: (E)-N-[6-chloranyl-2-cyclopropyl-5-(4-methylphenyl)pyrimidin-4-yl]-2-phenyl-ethenesulfonamide Openeye Name: (E)-N-[6-chloro-2-cyclopropyl-5-(p-tolyl)pyrimidin-4-yl]-2-phenyl-ethenesulfonamide CAS Name: (E)-N-[6-chloro-2-cyclopropyl-5-(4-methylphenyl)-4-pyrimidinyl]-2-phenylethenesulfonamide IUPAC Name: (E)-N-[6-chloro-2-cyclopropyl-5-(4-methylphenyl)pyrimidin-4-yl]-2-phenylethenesulfonamide Traditional Name: (E)-N-[6-chloro-2-cyclopropyl-5-(p-tolyl)pyrimidin-4-yl]-2-phenyl-ethenesulfonamide Formula: C22H20ClN3O2S MolecularWeight: 425.9311

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(N=C(N=C2Cl)C3CC3)NS(=O)(=O)C=CC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(N=C(N=C2Cl)C3CC3)NS(=O)(=O)/C=C/C4=CC=CC=C4

InChI

InChI=1S/C22H20ClN3O2S/c1-15-7-9-17(10-8-15)19-20(23)24-21(18-11-12-18)25-22(19)26-29(27,28)14-13-16-5-3-2-4-6-16/h2-10,13-14,18H,11-12H2,1H3,(H,24,25,26)/b14-13+