4-(4-chloranylphenoxy)-2-[(4-ethylsulfonylphenyl)amino]pyrimidine-5-carbonitrile

Systemtic Name: 4-(4-chloranylphenoxy)-2-[(4-ethylsulfonylphenyl)amino]pyrimidine-5-carbonitrile Openeye Name: 4-(4-chlorophenoxy)-2-(4-ethylsulfonylanilino)pyrimidine-5-carbonitrile CAS Name: 4-(4-chlorophenoxy)-2-(4-ethylsulfonylanilino)-5-pyrimidinecarbonitrile IUPAC Name: 4-(4-chlorophenoxy)-2-(4-ethylsulfonylanilino)pyrimidine-5-carbonitrile Traditional Name: 4-(4-chlorophenoxy)-2-(4-esylanilino)pyrimidine-5-carbonitrile Formula: C19H15ClN4O3S MolecularWeight: 414.8654

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC=C(C=C1)NC2=NC=C(C(=N2)OC3=CC=C(C=C3)Cl)C#N

Isomeric SMILES

CCS(=O)(=O)C1=CC=C(C=C1)NC2=NC=C(C(=N2)OC3=CC=C(C=C3)Cl)C#N

InChI

InChI=1S/C19H15ClN4O3S/c1-2-28(25,26)17-9-5-15(6-10-17)23-19-22-12-13(11-21)18(24-19)27-16-7-3-14(20)4-8-16/h3-10,12H,2H2,1H3,(H,22,23,24)