2-[bis(azanyl)methylideneamino]-N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)-1,3-thiazole-4-carboxamide

Systemtic Name: 2-[bis(azanyl)methylideneamino]-N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)-1,3-thiazole-4-carboxamide Openeye Name: 2-guanidino-N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)thiazole-4-carboxamide CAS Name: 2-(diaminomethylideneamino)-N-[6-(methylthio)-1,3-benzothiazol-2-yl]-4-thiazolecarboxamide IUPAC Name: 2-(diaminomethylideneamino)-N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)-1,3-thiazole-4-carboxamide Traditional Name: 2-guanidino-N-[6-(methylthio)-1,3-benzothiazol-2-yl]thiazole-4-carboxamide Formula: C13H12N6OS3 MolecularWeight: 364.46898

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CSC(=N3)N=C(N)N

Isomeric SMILES

CSC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CSC(=N3)N=C(N)N

InChI

InChI=1S/C13H12N6OS3/c1-21-6-2-3-7-9(4-6)23-13(16-7)18-10(20)8-5-22-12(17-8)19-11(14)15/h2-5H,1H3,(H,16,18,20)(H4,14,15,17,19)