(4-tert-butylphenoxy)methanamine; 3-butylsulfanyl-2,4,6-triazabicyclo[3.1.0]hexa-1(6),2,4-triene

Systemtic Name: (4-tert-butylphenoxy)methanamine; 3-butylsulfanyl-2,4,6-triazabicyclo[3.1.0]hexa-1(6),2,4-triene Openeye Name: (4-tert-butylphenoxy)methanamine; 3-butylsulfanyl-2,4,6-triazabicyclo[3.1.0]hexa-1(6),2,4-triene CAS Name: (4-tert-butylphenoxy)methanamine; 3-(butylthio)-2,4,6-triazabicyclo[3.1.0]hexa-1(6),2,4-triene IUPAC Name: (4-tert-butylphenoxy)methanamine; 3-butylsulfanyl-2,4,6-triazabicyclo[3.1.0]hexa-1(6),2,4-triene Traditional Name: (4-tert-butylphenoxy)methylamine; 3-(butylthio)-2,4,6-triazabicyclo[3.1.0]hexa-1(6),2,4-triene Formula: C18H26N4OS MolecularWeight: 346.49024

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=NC2=NC2=N1.CC(C)(C)C1=CC=C(C=C1)OCN

Isomeric SMILES

CCCCSC1=NC2=NC2=N1.CC(C)(C)C1=CC=C(C=C1)OCN

InChI

InChI=1S/C11H17NO.C7H9N3S/c1-11(2,3)9-4-6-10(7-5-9)13-8-12;1-2-3-4-11-7-9-5-6(8-5)10-7/h4-7H,8,12H2,1-3H3;2-4H2,1H3