2-[(4-tert-butylphenyl)methylsulfanyl]-6-chloranyl-pyrimidin-4-amine

Systemtic Name: 2-[(4-tert-butylphenyl)methylsulfanyl]-6-chloranyl-pyrimidin-4-amine Openeye Name: 2-[(4-tert-butylphenyl)methylsulfanyl]-6-chloro-pyrimidin-4-amine CAS Name: 2-[(4-tert-butylphenyl)methylthio]-6-chloro-4-pyrimidinamine IUPAC Name: 2-[(4-tert-butylphenyl)methylsulfanyl]-6-chloropyrimidin-4-amine Traditional Name: [2-[(4-tert-butylbenzyl)thio]-6-chloro-pyrimidin-4-yl]amine Formula: C15H18ClN3S MolecularWeight: 307.84152

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H18ClN3S/c1-15(2,3)11-6-4-10(5-7-11)9-20-14-18-12(16)8-13(17)19-14/h4-8H,9H2,1-3H3,(H2,17,18,19)