N5-(5-bromanyl-2-methyl-phenyl)-1,3-benzothiazole-4,5-diamine

Systemtic Name: N5-(5-bromanyl-2-methyl-phenyl)-1,3-benzothiazole-4,5-diamine Openeye Name: N5-(5-bromo-2-methyl-phenyl)-1,3-benzothiazole-4,5-diamine CAS Name: N5-(5-bromo-2-methylphenyl)-1,3-benzothiazole-4,5-diamine IUPAC Name: 5-N-(5-bromo-2-methylphenyl)-1,3-benzothiazole-4,5-diamine Traditional Name: (4-amino-1,3-benzothiazol-5-yl)-(5-bromo-2-methyl-phenyl)amine Formula: C14H12BrN3S MolecularWeight: 334.23418

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Br)NC2=C(C3=C(C=C2)SC=N3)N

Isomeric SMILES

CC1=C(C=C(C=C1)Br)NC2=C(C3=C(C=C2)SC=N3)N

InChI

InChI=1S/C14H12BrN3S/c1-8-2-3-9(15)6-11(8)18-10-4-5-12-14(13(10)16)17-7-19-12/h2-7,18H,16H2,1H3