4-[(5-cyano-4-prop-2-ynoxy-pyrimidin-2-yl)amino]-N,N-dimethyl-benzenesulfonamide

Systemtic Name: 4-[(5-cyano-4-prop-2-ynoxy-pyrimidin-2-yl)amino]-N,N-dimethyl-benzenesulfonamide Openeye Name: 4-[(5-cyano-4-prop-2-ynoxy-pyrimidin-2-yl)amino]-N,N-dimethyl-benzenesulfonamide CAS Name: 4-[(5-cyano-4-prop-2-ynoxy-2-pyrimidinyl)amino]-N,N-dimethylbenzenesulfonamide IUPAC Name: 4-[(5-cyano-4-prop-2-ynoxypyrimidin-2-yl)amino]-N,N-dimethylbenzenesulfonamide Traditional Name: 4-[(5-cyano-4-propargyloxy-pyrimidin-2-yl)amino]-N,N-dimethyl-benzenesulfonamide Formula: C16H15N5O3S MolecularWeight: 357.387

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC=C(C=C1)NC2=NC=C(C(=N2)OCC#C)C#N

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC=C(C=C1)NC2=NC=C(C(=N2)OCC#C)C#N

InChI

InChI=1S/C16H15N5O3S/c1-4-9-24-15-12(10-17)11-18-16(20-15)19-13-5-7-14(8-6-13)25(22,23)21(2)3/h1,5-8,11H,9H2,2-3H3,(H,18,19,20)