N'-[5-azanyl-6-(pyridin-4-ylamino)pyrimidin-4-yl]-4-methyl-benzenesulfonohydrazide

Systemtic Name: N'-[5-azanyl-6-(pyridin-4-ylamino)pyrimidin-4-yl]-4-methyl-benzenesulfonohydrazide Openeye Name: N'-[5-amino-6-(4-pyridylamino)pyrimidin-4-yl]-4-methyl-benzenesulfonohydrazide CAS Name: N'-[5-amino-6-(pyridin-4-ylamino)-4-pyrimidinyl]-4-methylbenzenesulfonohydrazide IUPAC Name: N'-[5-amino-6-(pyridin-4-ylamino)pyrimidin-4-yl]-4-methylbenzenesulfonohydrazide Traditional Name: N'-[5-amino-6-(4-pyridylamino)pyrimidin-4-yl]-4-methyl-benzenesulfonohydrazide Formula: C16H17N7O2S MolecularWeight: 371.41688

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NNC2=NC=NC(=C2N)NC3=CC=NC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NNC2=NC=NC(=C2N)NC3=CC=NC=C3

InChI

InChI=1S/C16H17N7O2S/c1-11-2-4-13(5-3-11)26(24,25)23-22-16-14(17)15(19-10-20-16)21-12-6-8-18-9-7-12/h2-10,23H,17H2,1H3,(H2,18,19,20,21,22)