1-butylsulfanyl-[1,2,4]triazolo[3,4-b][1,3]benzothiazole

Systemtic Name: 1-butylsulfanyl-[1,2,4]triazolo[3,4-b][1,3]benzothiazole Openeye Name: 1-butylsulfanyl-[1,2,4]triazolo[3,4-b][1,3]benzothiazole CAS Name: 1-(butylthio)-[1,2,4]triazolo[3,4-b][1,3]benzothiazole IUPAC Name: 1-butylsulfanyl-[1,2,4]triazolo[3,4-b][1,3]benzothiazole Traditional Name: 1-(butylthio)-[1,2,4]triazolo[3,4-b][1,3]benzothiazole Formula: C12H13N3S2 MolecularWeight: 263.38172

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=NN=C2N1C3=CC=CC=C3S2

Isomeric SMILES

CCCCSC1=NN=C2N1C3=CC=CC=C3S2

InChI

InChI=1S/C12H13N3S2/c1-2-3-8-16-11-13-14-12-15(11)9-6-4-5-7-10(9)17-12/h4-7H,2-3,8H2,1H3