2-[(4-propan-2-ylphenyl)methylsulfanyl]pyrimidine-4,6-diamine

Systemtic Name: 2-[(4-propan-2-ylphenyl)methylsulfanyl]pyrimidine-4,6-diamine Openeye Name: 2-[(4-isopropylphenyl)methylsulfanyl]pyrimidine-4,6-diamine CAS Name: 2-[(4-propan-2-ylphenyl)methylthio]pyrimidine-4,6-diamine IUPAC Name: 2-[(4-propan-2-ylphenyl)methylsulfanyl]pyrimidine-4,6-diamine Traditional Name: [6-amino-2-[(4-isopropylbenzyl)thio]pyrimidin-4-yl]amine Formula: C14H18N4S MolecularWeight: 274.38452

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)CSC2=NC(=CC(=N2)N)N

Isomeric SMILES

CC(C)C1=CC=C(C=C1)CSC2=NC(=CC(=N2)N)N

InChI

InChI=1S/C14H18N4S/c1-9(2)11-5-3-10(4-6-11)8-19-14-17-12(15)7-13(16)18-14/h3-7,9H,8H2,1-2H3,(H4,15,16,17,18)