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

Systemtic Name: 4-[(5-cyano-4-prop-2-ynoxy-pyrimidin-2-yl)amino]-N-prop-2-enyl-benzenesulfonamide Openeye Name: N-allyl-4-[(5-cyano-4-prop-2-ynoxy-pyrimidin-2-yl)amino]benzenesulfonamide CAS Name: 4-[(5-cyano-4-prop-2-ynoxy-2-pyrimidinyl)amino]-N-prop-2-enylbenzenesulfonamide IUPAC Name: 4-[(5-cyano-4-prop-2-ynoxypyrimidin-2-yl)amino]-N-prop-2-enylbenzenesulfonamide Traditional Name: N-allyl-4-[(5-cyano-4-propargyloxy-pyrimidin-2-yl)amino]benzenesulfonamide Formula: C17H15N5O3S MolecularWeight: 369.3977

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H15N5O3S/c1-3-9-20-26(23,24)15-7-5-14(6-8-15)21-17-19-12-13(11-18)16(22-17)25-10-4-2/h2-3,5-8,12,20H,1,9-10H2,(H,19,21,22)