N1,N1-dimethyl-4-pyridin-4-yl-N3-pyrimidin-2-yl-benzene-1,3-diamine; sulfuric acid

Systemtic Name: N1,N1-dimethyl-4-pyridin-4-yl-N3-pyrimidin-2-yl-benzene-1,3-diamine; sulfuric acid Openeye Name: N1,N1-dimethyl-4-(4-pyridyl)-N3-pyrimidin-2-yl-benzene-1,3-diamine; sulfuric acid CAS Name: N1,N1-dimethyl-4-pyridin-4-yl-N3-(2-pyrimidinyl)benzene-1,3-diamine; sulfuric acid IUPAC Name: 1-N,1-N-dimethyl-4-pyridin-4-yl-3-N-pyrimidin-2-ylbenzene-1,3-diamine; sulfuric acid Traditional Name: dimethyl-[4-(4-pyridyl)-3-(2-pyrimidylamino)phenyl]amine; sulfuric acid Formula: C17H19N5O4S MolecularWeight: 389.42886

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC(=C(C=C1)C2=CC=NC=C2)NC3=NC=CC=N3.OS(=O)(=O)O

Isomeric SMILES

CN(C)C1=CC(=C(C=C1)C2=CC=NC=C2)NC3=NC=CC=N3.OS(=O)(=O)O

InChI

InChI=1S/C17H17N5.H2O4S/c1-22(2)14-4-5-15(13-6-10-18-11-7-13)16(12-14)21-17-19-8-3-9-20-17;1-5(2,3)4/h3-12H,1-2H3,(H,19,20,21);(H2,1,2,3,4)