4-[(4-azanyl-5-cyano-pyrimidin-2-yl)amino]-N-[3-(dimethylamino)propyl]benzenesulfonamide

Systemtic Name: 4-[(4-azanyl-5-cyano-pyrimidin-2-yl)amino]-N-[3-(dimethylamino)propyl]benzenesulfonamide Openeye Name: 4-[(4-amino-5-cyano-pyrimidin-2-yl)amino]-N-[3-(dimethylamino)propyl]benzenesulfonamide CAS Name: 4-[(4-amino-5-cyano-2-pyrimidinyl)amino]-N-[3-(dimethylamino)propyl]benzenesulfonamide IUPAC Name: 4-[(4-amino-5-cyanopyrimidin-2-yl)amino]-N-[3-(dimethylamino)propyl]benzenesulfonamide Traditional Name: 4-[(4-amino-5-cyano-pyrimidin-2-yl)amino]-N-[3-(dimethylamino)propyl]benzenesulfonamide Formula: C16H21N7O2S MolecularWeight: 375.44864

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCNS(=O)(=O)C1=CC=C(C=C1)NC2=NC=C(C(=N2)N)C#N

Isomeric SMILES

CN(C)CCCNS(=O)(=O)C1=CC=C(C=C1)NC2=NC=C(C(=N2)N)C#N

InChI

InChI=1S/C16H21N7O2S/c1-23(2)9-3-8-20-26(24,25)14-6-4-13(5-7-14)21-16-19-11-12(10-17)15(18)22-16/h4-7,11,20H,3,8-9H2,1-2H3,(H3,18,19,21,22)