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

Systemtic Name: 2-[bis(azanyl)methylideneamino]-N-(6-sulfamoyl-1,3-benzothiazol-2-yl)-1,3-thiazole-4-carboxamide Openeye Name: 2-guanidino-N-(6-sulfamoyl-1,3-benzothiazol-2-yl)thiazole-4-carboxamide CAS Name: 2-(diaminomethylideneamino)-N-(6-sulfamoyl-1,3-benzothiazol-2-yl)-4-thiazolecarboxamide IUPAC Name: 2-(diaminomethylideneamino)-N-(6-sulfamoyl-1,3-benzothiazol-2-yl)-1,3-thiazole-4-carboxamide Traditional Name: 2-guanidino-N-(6-sulfamoyl-1,3-benzothiazol-2-yl)thiazole-4-carboxamide Formula: C12H11N7O3S3 MolecularWeight: 397.45584

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1S(=O)(=O)N)SC(=N2)NC(=O)C3=CSC(=N3)N=C(N)N

Isomeric SMILES

C1=CC2=C(C=C1S(=O)(=O)N)SC(=N2)NC(=O)C3=CSC(=N3)N=C(N)N

InChI

InChI=1S/C12H11N7O3S3/c13-10(14)19-11-17-7(4-23-11)9(20)18-12-16-6-2-1-5(25(15,21)22)3-8(6)24-12/h1-4H,(H2,15,21,22)(H,16,18,20)(H4,13,14,17,19)