2-[(4-ethylsulfonylphenyl)amino]-4-(furan-3-yloxy)pyrimidine-5-carbonitrile

Systemtic Name: 2-[(4-ethylsulfonylphenyl)amino]-4-(furan-3-yloxy)pyrimidine-5-carbonitrile Openeye Name: 2-(4-ethylsulfonylanilino)-4-(3-furyloxy)pyrimidine-5-carbonitrile CAS Name: 2-(4-ethylsulfonylanilino)-4-(3-furanyloxy)-5-pyrimidinecarbonitrile IUPAC Name: 2-(4-ethylsulfonylanilino)-4-(furan-3-yloxy)pyrimidine-5-carbonitrile Traditional Name: 2-(4-esylanilino)-4-(3-furyloxy)pyrimidine-5-carbonitrile Formula: C17H14N4O4S MolecularWeight: 370.38246

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H14N4O4S/c1-2-26(22,23)15-5-3-13(4-6-15)20-17-19-10-12(9-18)16(21-17)25-14-7-8-24-11-14/h3-8,10-11H,2H2,1H3,(H,19,20,21)