N4-tert-butyl-6-quinolin-8-ylsulfanyl-pyrimidine-4,5-diamine

Systemtic Name: N4-tert-butyl-6-quinolin-8-ylsulfanyl-pyrimidine-4,5-diamine Openeye Name: N4-tert-butyl-6-(8-quinolylsulfanyl)pyrimidine-4,5-diamine CAS Name: N4-tert-butyl-6-(8-quinolinylthio)pyrimidine-4,5-diamine IUPAC Name: 4-N-tert-butyl-6-quinolin-8-ylsulfanylpyrimidine-4,5-diamine Traditional Name: [5-amino-6-(8-quinolylthio)pyrimidin-4-yl]-tert-butyl-amine Formula: C17H19N5S MolecularWeight: 325.43126

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC1=C(C(=NC=N1)SC2=CC=CC3=C2N=CC=C3)N

Isomeric SMILES

CC(C)(C)NC1=C(C(=NC=N1)SC2=CC=CC3=C2N=CC=C3)N

InChI

InChI=1S/C17H19N5S/c1-17(2,3)22-15-13(18)16(21-10-20-15)23-12-8-4-6-11-7-5-9-19-14(11)12/h4-10H,18H2,1-3H3,(H,20,21,22)