N-[6-chloranyl-5-(4-methylsulfanylphenyl)pyrimidin-4-yl]-4-propan-2-yl-benzenesulfonamide

Systemtic Name: N-[6-chloranyl-5-(4-methylsulfanylphenyl)pyrimidin-4-yl]-4-propan-2-yl-benzenesulfonamide Openeye Name: N-[6-chloro-5-(4-methylsulfanylphenyl)pyrimidin-4-yl]-4-isopropyl-benzenesulfonamide CAS Name: N-[6-chloro-5-[4-(methylthio)phenyl]-4-pyrimidinyl]-4-propan-2-ylbenzenesulfonamide IUPAC Name: N-[6-chloro-5-(4-methylsulfanylphenyl)pyrimidin-4-yl]-4-propan-2-ylbenzenesulfonamide Traditional Name: N-[6-chloro-5-[4-(methylthio)phenyl]pyrimidin-4-yl]-4-isopropyl-benzenesulfonamide Formula: C20H20ClN3O2S2 MolecularWeight: 433.9747

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)S(=O)(=O)NC2=C(C(=NC=N2)Cl)C3=CC=C(C=C3)SC

Isomeric SMILES

CC(C)C1=CC=C(C=C1)S(=O)(=O)NC2=C(C(=NC=N2)Cl)C3=CC=C(C=C3)SC

InChI

InChI=1S/C20H20ClN3O2S2/c1-13(2)14-6-10-17(11-7-14)28(25,26)24-20-18(19(21)22-12-23-20)15-4-8-16(27-3)9-5-15/h4-13H,1-3H3,(H,22,23,24)