N4-(oxolan-2-ylmethyl)-6-quinolin-8-ylsulfanyl-pyrimidine-4,5-diamine

Systemtic Name: N4-(oxolan-2-ylmethyl)-6-quinolin-8-ylsulfanyl-pyrimidine-4,5-diamine Openeye Name: 6-(8-quinolylsulfanyl)-N4-(tetrahydrofuran-2-ylmethyl)pyrimidine-4,5-diamine CAS Name: N4-(2-oxolanylmethyl)-6-(8-quinolinylthio)pyrimidine-4,5-diamine IUPAC Name: 4-N-(oxolan-2-ylmethyl)-6-quinolin-8-ylsulfanylpyrimidine-4,5-diamine Traditional Name: [5-amino-6-(8-quinolylthio)pyrimidin-4-yl]-(tetrahydrofurfuryl)amine Formula: C18H19N5OS MolecularWeight: 353.44136

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC2=C(C(=NC=N2)SC3=CC=CC4=C3N=CC=C4)N

Isomeric SMILES

C1CC(OC1)CNC2=C(C(=NC=N2)SC3=CC=CC4=C3N=CC=C4)N

InChI

InChI=1S/C18H19N5OS/c19-15-17(21-10-13-6-3-9-24-13)22-11-23-18(15)25-14-7-1-4-12-5-2-8-20-16(12)14/h1-2,4-5,7-8,11,13H,3,6,9-10,19H2,(H,21,22,23)