3-[[2-[(N'-methylcarbamimidoyl)amino]-1,3-thiazol-4-yl]methylsulfanyl]-N'-sulfamoyl-propanimidamide

Systemtic Name: 3-[[2-[(N'-methylcarbamimidoyl)amino]-1,3-thiazol-4-yl]methylsulfanyl]-N'-sulfamoyl-propanimidamide Openeye Name: 3-[[2-[(N'-methylcarbamimidoyl)amino]thiazol-4-yl]methylsulfanyl]-N'-sulfamoyl-propanamidine CAS Name: 3-[[2-[[amino(methylimino)methyl]amino]-4-thiazolyl]methylthio]-N'-sulfamoylpropanimidamide IUPAC Name: 3-[[2-[(N'-methylcarbamimidoyl)amino]-1,3-thiazol-4-yl]methylsulfanyl]-N'-sulfamoylpropanimidamide Traditional Name: 3-[[2-[(N'-methylamidino)amino]thiazol-4-yl]methylthio]-N'-sulfamoyl-propionamidine Formula: C9H17N7O2S3 MolecularWeight: 351.47198

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Descriptors Computed from Structure

Canonical SMILES:

CN=C(N)NC1=NC(=CS1)CSCCC(=NS(=O)(=O)N)N

Isomeric SMILES

CN=C(N)NC1=NC(=CS1)CSCC/C(=N/S(=O)(=O)N)/N

InChI

InChI=1S/C9H17N7O2S3/c1-13-8(11)15-9-14-6(5-20-9)4-19-3-2-7(10)16-21(12,17)18/h5H,2-4H2,1H3,(H2,10,16)(H2,12,17,18)(H3,11,13,14,15)