4-[bis(azanyl)methylideneamino]-N-methyl-N-(4-oxidanylidene-3,1-benzothiazin-2-yl)butanamide

Systemtic Name: 4-[bis(azanyl)methylideneamino]-N-methyl-N-(4-oxidanylidene-3,1-benzothiazin-2-yl)butanamide Openeye Name: 4-guanidino-N-methyl-N-(4-oxo-3,1-benzothiazin-2-yl)butanamide CAS Name: 4-(diaminomethylideneamino)-N-methyl-N-(4-oxo-3,1-benzothiazin-2-yl)butanamide IUPAC Name: 4-(diaminomethylideneamino)-N-methyl-N-(4-oxo-3,1-benzothiazin-2-yl)butanamide Traditional Name: 4-guanidino-N-(4-keto-3,1-benzothiazin-2-yl)-N-methyl-butyramide Formula: C14H17N5O2S MolecularWeight: 319.38208

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=NC2=CC=CC=C2C(=O)S1)C(=O)CCCN=C(N)N

Isomeric SMILES

CN(C1=NC2=CC=CC=C2C(=O)S1)C(=O)CCCN=C(N)N

InChI

InChI=1S/C14H17N5O2S/c1-19(11(20)7-4-8-17-13(15)16)14-18-10-6-3-2-5-9(10)12(21)22-14/h2-3,5-6H,4,7-8H2,1H3,(H4,15,16,17)