N-[1,1-bis(oxidanylidene)thian-4-yl]-7-chloranyl-1,3-benzothiazol-2-amine

Systemtic Name: N-[1,1-bis(oxidanylidene)thian-4-yl]-7-chloranyl-1,3-benzothiazol-2-amine Openeye Name: 7-chloro-N-(1,1-dioxothian-4-yl)-1,3-benzothiazol-2-amine CAS Name: 7-chloro-N-(1,1-dioxo-4-thianyl)-1,3-benzothiazol-2-amine IUPAC Name: 7-chloro-N-(1,1-dioxothian-4-yl)-1,3-benzothiazol-2-amine Traditional Name: (7-chloro-1,3-benzothiazol-2-yl)-(1,1-diketothian-4-yl)amine Formula: C12H13ClN2O2S2 MolecularWeight: 316.82682

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CCC1NC2=NC3=C(S2)C(=CC=C3)Cl

Isomeric SMILES

C1CS(=O)(=O)CCC1NC2=NC3=C(S2)C(=CC=C3)Cl

InChI

InChI=1S/C12H13ClN2O2S2/c13-9-2-1-3-10-11(9)18-12(15-10)14-8-4-6-19(16,17)7-5-8/h1-3,8H,4-7H2,(H,14,15)