2-[bis(azanyl)methylideneamino]-N-(7-chloranyl-4-ethoxy-1,3-benzothiazol-2-yl)-1,3-thiazole-4-carboxamide

Systemtic Name: 2-[bis(azanyl)methylideneamino]-N-(7-chloranyl-4-ethoxy-1,3-benzothiazol-2-yl)-1,3-thiazole-4-carboxamide Openeye Name: N-(7-chloro-4-ethoxy-1,3-benzothiazol-2-yl)-2-guanidino-thiazole-4-carboxamide CAS Name: N-(7-chloro-4-ethoxy-1,3-benzothiazol-2-yl)-2-(diaminomethylideneamino)-4-thiazolecarboxamide IUPAC Name: N-(7-chloro-4-ethoxy-1,3-benzothiazol-2-yl)-2-(diaminomethylideneamino)-1,3-thiazole-4-carboxamide Traditional Name: N-(7-chloro-4-ethoxy-1,3-benzothiazol-2-yl)-2-guanidino-thiazole-4-carboxamide Formula: C14H13ClN6O2S2 MolecularWeight: 396.87502

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C2C(=C(C=C1)Cl)SC(=N2)NC(=O)C3=CSC(=N3)N=C(N)N

Isomeric SMILES

CCOC1=C2C(=C(C=C1)Cl)SC(=N2)NC(=O)C3=CSC(=N3)N=C(N)N

InChI

InChI=1S/C14H13ClN6O2S2/c1-2-23-8-4-3-6(15)10-9(8)19-14(25-10)20-11(22)7-5-24-13(18-7)21-12(16)17/h3-5H,2H2,1H3,(H,19,20,22)(H4,16,17,18,21)