4-methyl-N-[4-[(6-thiophen-3-ylpyrimidin-4-yl)amino]phenyl]benzenesulfonamide

Systemtic Name: 4-methyl-N-[4-[(6-thiophen-3-ylpyrimidin-4-yl)amino]phenyl]benzenesulfonamide Openeye Name: 4-methyl-N-[4-[[6-(3-thienyl)pyrimidin-4-yl]amino]phenyl]benzenesulfonamide CAS Name: 4-methyl-N-[4-[[6-(3-thiophenyl)-4-pyrimidinyl]amino]phenyl]benzenesulfonamide IUPAC Name: 4-methyl-N-[4-[(6-thiophen-3-ylpyrimidin-4-yl)amino]phenyl]benzenesulfonamide Traditional Name: 4-methyl-N-[4-[[6-(3-thienyl)pyrimidin-4-yl]amino]phenyl]benzenesulfonamide Formula: C21H18N4O2S2 MolecularWeight: 422.52322

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)NC3=NC=NC(=C3)C4=CSC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)NC3=NC=NC(=C3)C4=CSC=C4

InChI

InChI=1S/C21H18N4O2S2/c1-15-2-8-19(9-3-15)29(26,27)25-18-6-4-17(5-7-18)24-21-12-20(22-14-23-21)16-10-11-28-13-16/h2-14,25H,1H3,(H,22,23,24)