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

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

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Descriptors Computed from Structure

Canonical SMILES:

C#CCOC1=NC(=NC=C1C#N)NC2=CC=C(C=C2)S(=O)(=O)NC3CC3

Isomeric SMILES

C#CCOC1=NC(=NC=C1C#N)NC2=CC=C(C=C2)S(=O)(=O)NC3CC3

InChI

InChI=1S/C17H15N5O3S/c1-2-9-25-16-12(10-18)11-19-17(21-16)20-13-5-7-15(8-6-13)26(23,24)22-14-3-4-14/h1,5-8,11,14,22H,3-4,9H2,(H,19,20,21)