5-bromanyl-2-[2-(sulfinoamino)oxyethoxy]pyrimidine; 4-[3-tert-butyl-5-(4-methylphenyl)phenyl]-5-propyl-pyrimidine

Systemtic Name: 5-bromanyl-2-[2-(sulfinoamino)oxyethoxy]pyrimidine; 4-[3-tert-butyl-5-(4-methylphenyl)phenyl]-5-propyl-pyrimidine Openeye Name: 5-bromo-2-[2-(sulfinoamino)oxyethoxy]pyrimidine; 4-[3-tert-butyl-5-(p-tolyl)phenyl]-5-propyl-pyrimidine CAS Name: 5-bromo-2-[2-(sulfinoamino)oxyethoxy]pyrimidine; 4-[3-tert-butyl-5-(4-methylphenyl)phenyl]-5-propylpyrimidine IUPAC Name: 5-bromo-2-[2-(sulfinoamino)oxyethoxy]pyrimidine; 4-[3-tert-butyl-5-(4-methylphenyl)phenyl]-5-propylpyrimidine Traditional Name: 5-bromo-2-[2-(sulfinoamino)oxyethoxy]pyrimidine; 4-[3-tert-butyl-5-(p-tolyl)phenyl]-5-propyl-pyrimidine Formula: C30H36BrN5O4S MolecularWeight: 642.60694

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CN=CN=C1C2=CC(=CC(=C2)C3=CC=C(C=C3)C)C(C)(C)C.C1=C(C=NC(=N1)OCCONS(=O)O)Br

Isomeric SMILES

CCCC1=CN=CN=C1C2=CC(=CC(=C2)C3=CC=C(C=C3)C)C(C)(C)C.C1=C(C=NC(=N1)OCCONS(=O)O)Br

InChI

InChI=1S/C24H28N2.C6H8BrN3O4S/c1-6-7-19-15-25-16-26-23(19)21-12-20(13-22(14-21)24(3,4)5)18-10-8-17(2)9-11-18;7-5-3-8-6(9-4-5)13-1-2-14-10-15(11)12/h8-16H,6-7H2,1-5H3;3-4,10H,1-2H2,(H,11,12)