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

Systemtic Name: 4-[(4-azanyl-5-cyano-pyrimidin-2-yl)amino]-N-phenethyl-benzenesulfonamide Openeye Name: 4-[(4-amino-5-cyano-pyrimidin-2-yl)amino]-N-phenethyl-benzenesulfonamide CAS Name: 4-[(4-amino-5-cyano-2-pyrimidinyl)amino]-N-phenethylbenzenesulfonamide IUPAC Name: 4-[(4-amino-5-cyanopyrimidin-2-yl)amino]-N-phenethylbenzenesulfonamide Traditional Name: 4-[(4-amino-5-cyano-pyrimidin-2-yl)amino]-N-phenethyl-benzenesulfonamide Formula: C19H18N6O2S MolecularWeight: 394.45022

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H18N6O2S/c20-12-15-13-22-19(25-18(15)21)24-16-6-8-17(9-7-16)28(26,27)23-11-10-14-4-2-1-3-5-14/h1-9,13,23H,10-11H2,(H3,21,22,24,25)