N5-[1,1-bis(oxidanylidene)thian-4-yl]-1,3-benzothiazole-4,5-diamine

Systemtic Name: N5-[1,1-bis(oxidanylidene)thian-4-yl]-1,3-benzothiazole-4,5-diamine Openeye Name: N5-(1,1-dioxothian-4-yl)-1,3-benzothiazole-4,5-diamine CAS Name: N5-(1,1-dioxo-4-thianyl)-1,3-benzothiazole-4,5-diamine IUPAC Name: 5-N-(1,1-dioxothian-4-yl)-1,3-benzothiazole-4,5-diamine Traditional Name: (4-amino-1,3-benzothiazol-5-yl)-(1,1-diketothian-4-yl)amine Formula: C12H15N3O2S2 MolecularWeight: 297.3964

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CCC1NC2=C(C3=C(C=C2)SC=N3)N

Isomeric SMILES

C1CS(=O)(=O)CCC1NC2=C(C3=C(C=C2)SC=N3)N

InChI

InChI=1S/C12H15N3O2S2/c13-11-9(1-2-10-12(11)14-7-18-10)15-8-3-5-19(16,17)6-4-8/h1-2,7-8,15H,3-6,13H2