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

Systemtic Name: 4-[(5-cyano-4-prop-2-ynoxy-pyrimidin-2-yl)amino]-N-(2-methoxyethyl)benzenesulfonamide Openeye Name: 4-[(5-cyano-4-prop-2-ynoxy-pyrimidin-2-yl)amino]-N-(2-methoxyethyl)benzenesulfonamide CAS Name: 4-[(5-cyano-4-prop-2-ynoxy-2-pyrimidinyl)amino]-N-(2-methoxyethyl)benzenesulfonamide IUPAC Name: 4-[(5-cyano-4-prop-2-ynoxypyrimidin-2-yl)amino]-N-(2-methoxyethyl)benzenesulfonamide Traditional Name: 4-[(5-cyano-4-propargyloxy-pyrimidin-2-yl)amino]-N-(2-methoxyethyl)benzenesulfonamide Formula: C17H17N5O4S MolecularWeight: 387.41298

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17N5O4S/c1-3-9-26-16-13(11-18)12-19-17(22-16)21-14-4-6-15(7-5-14)27(23,24)20-8-10-25-2/h1,4-7,12,20H,8-10H2,2H3,(H,19,21,22)