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

Systemtic Name: 2-[bis(azanyl)methylideneamino]-N-(6-methoxy-1,3-benzothiazol-2-yl)-1,3-thiazole-4-carboxamide Openeye Name: 2-guanidino-N-(6-methoxy-1,3-benzothiazol-2-yl)thiazole-4-carboxamide CAS Name: 2-(diaminomethylideneamino)-N-(6-methoxy-1,3-benzothiazol-2-yl)-4-thiazolecarboxamide IUPAC Name: 2-(diaminomethylideneamino)-N-(6-methoxy-1,3-benzothiazol-2-yl)-1,3-thiazole-4-carboxamide Traditional Name: 2-guanidino-N-(6-methoxy-1,3-benzothiazol-2-yl)thiazole-4-carboxamide Formula: C13H12N6O2S2 MolecularWeight: 348.40338

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CSC(=N3)N=C(N)N

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CSC(=N3)N=C(N)N

InChI

InChI=1S/C13H12N6O2S2/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)