N4-(6-methylpyridin-2-yl)-N6-(2-thiophen-2-ylethyl)pyrimidine-4,5,6-triamine

Systemtic Name: N4-(6-methylpyridin-2-yl)-N6-(2-thiophen-2-ylethyl)pyrimidine-4,5,6-triamine Openeye Name: N4-(6-methyl-2-pyridyl)-N6-[2-(2-thienyl)ethyl]pyrimidine-4,5,6-triamine CAS Name: N4-(6-methyl-2-pyridinyl)-N6-(2-thiophen-2-ylethyl)pyrimidine-4,5,6-triamine IUPAC Name: 4-N-(6-methylpyridin-2-yl)-6-N-(2-thiophen-2-ylethyl)pyrimidine-4,5,6-triamine Traditional Name: [5-amino-6-[(6-methyl-2-pyridyl)amino]pyrimidin-4-yl]-[2-(2-thienyl)ethyl]amine Formula: C16H18N6S MolecularWeight: 326.41932

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC=C1)NC2=C(C(=NC=N2)NCCC3=CC=CS3)N

Isomeric SMILES

CC1=NC(=CC=C1)NC2=C(C(=NC=N2)NCCC3=CC=CS3)N

InChI

InChI=1S/C16H18N6S/c1-11-4-2-6-13(21-11)22-16-14(17)15(19-10-20-16)18-8-7-12-5-3-9-23-12/h2-6,9-10H,7-8,17H2,1H3,(H2,18,19,20,21,22)