6-(4-methylphenyl)sulfanyl-N4-(oxolan-2-ylmethyl)pyrimidine-4,5-diamine

Systemtic Name: 6-(4-methylphenyl)sulfanyl-N4-(oxolan-2-ylmethyl)pyrimidine-4,5-diamine Openeye Name: 6-(p-tolylsulfanyl)-N4-(tetrahydrofuran-2-ylmethyl)pyrimidine-4,5-diamine CAS Name: 6-[(4-methylphenyl)thio]-N4-(2-oxolanylmethyl)pyrimidine-4,5-diamine IUPAC Name: 6-(4-methylphenyl)sulfanyl-4-N-(oxolan-2-ylmethyl)pyrimidine-4,5-diamine Traditional Name: [5-amino-6-(p-tolylthio)pyrimidin-4-yl]-(tetrahydrofurfuryl)amine Formula: C16H20N4OS MolecularWeight: 316.4212

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=NC=NC(=C2N)NCC3CCCO3

Isomeric SMILES

CC1=CC=C(C=C1)SC2=NC=NC(=C2N)NCC3CCCO3

InChI

InChI=1S/C16H20N4OS/c1-11-4-6-13(7-5-11)22-16-14(17)15(19-10-20-16)18-9-12-3-2-8-21-12/h4-7,10,12H,2-3,8-9,17H2,1H3,(H,18,19,20)