4-[(4-azanyl-5-cyano-pyrimidin-2-yl)amino]-N-[2-(4-hydroxyphenyl)ethyl]benzenesulfonamide

Systemtic Name: 4-[(4-azanyl-5-cyano-pyrimidin-2-yl)amino]-N-[2-(4-hydroxyphenyl)ethyl]benzenesulfonamide Openeye Name: 4-[(4-amino-5-cyano-pyrimidin-2-yl)amino]-N-[2-(4-hydroxyphenyl)ethyl]benzenesulfonamide CAS Name: 4-[(4-amino-5-cyano-2-pyrimidinyl)amino]-N-[2-(4-hydroxyphenyl)ethyl]benzenesulfonamide IUPAC Name: 4-[(4-amino-5-cyanopyrimidin-2-yl)amino]-N-[2-(4-hydroxyphenyl)ethyl]benzenesulfonamide Traditional Name: 4-[(4-amino-5-cyano-pyrimidin-2-yl)amino]-N-[2-(4-hydroxyphenyl)ethyl]benzenesulfonamide Formula: C19H18N6O3S MolecularWeight: 410.44962

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCNS(=O)(=O)C2=CC=C(C=C2)NC3=NC=C(C(=N3)N)C#N)O

Isomeric SMILES

C1=CC(=CC=C1CCNS(=O)(=O)C2=CC=C(C=C2)NC3=NC=C(C(=N3)N)C#N)O

InChI

InChI=1S/C19H18N6O3S/c20-11-14-12-22-19(25-18(14)21)24-15-3-7-17(8-4-15)29(27,28)23-10-9-13-1-5-16(26)6-2-13/h1-8,12,23,26H,9-10H2,(H3,21,22,24,25)