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

Systemtic Name: 2-[bis(azanyl)methylideneamino]-N-(6-chloranyl-4-methyl-1,3-benzothiazol-2-yl)-1,3-thiazole-4-carboxamide Openeye Name: N-(6-chloro-4-methyl-1,3-benzothiazol-2-yl)-2-guanidino-thiazole-4-carboxamide CAS Name: N-(6-chloro-4-methyl-1,3-benzothiazol-2-yl)-2-(diaminomethylideneamino)-4-thiazolecarboxamide IUPAC Name: N-(6-chloro-4-methyl-1,3-benzothiazol-2-yl)-2-(diaminomethylideneamino)-1,3-thiazole-4-carboxamide Traditional Name: N-(6-chloro-4-methyl-1,3-benzothiazol-2-yl)-2-guanidino-thiazole-4-carboxamide Formula: C13H11ClN6OS2 MolecularWeight: 366.84904

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC2=C1N=C(S2)NC(=O)C3=CSC(=N3)N=C(N)N)Cl

Isomeric SMILES

CC1=CC(=CC2=C1N=C(S2)NC(=O)C3=CSC(=N3)N=C(N)N)Cl

InChI

InChI=1S/C13H11ClN6OS2/c1-5-2-6(14)3-8-9(5)18-13(23-8)19-10(21)7-4-22-12(17-7)20-11(15)16/h2-4H,1H3,(H,18,19,21)(H4,15,16,17,20)