3-[[4-(dimethylaminomethyl)pyridin-2-yl]methylsulfanyl]-N'-sulfamoyl-propanimidamide

Systemtic Name: 3-[[4-(dimethylaminomethyl)pyridin-2-yl]methylsulfanyl]-N'-sulfamoyl-propanimidamide Openeye Name: 3-[[4-(dimethylaminomethyl)-2-pyridyl]methylsulfanyl]-N'-sulfamoyl-propanamidine CAS Name: 3-[[4-(dimethylaminomethyl)-2-pyridinyl]methylthio]-N'-sulfamoylpropanimidamide IUPAC Name: 3-[[4-(dimethylaminomethyl)pyridin-2-yl]methylsulfanyl]-N'-sulfamoylpropanimidamide Traditional Name: 3-[[4-(dimethylaminomethyl)-2-pyridyl]methylthio]-N'-sulfamoyl-propionamidine Formula: C12H21N5O2S2 MolecularWeight: 331.45744

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=CC(=NC=C1)CSCCC(=NS(=O)(=O)N)N

Isomeric SMILES

CN(C)CC1=CC(=NC=C1)CSCC/C(=N\S(=O)(=O)N)/N

InChI

InChI=1S/C12H21N5O2S2/c1-17(2)8-10-3-5-15-11(7-10)9-20-6-4-12(13)16-21(14,18)19/h3,5,7H,4,6,8-9H2,1-2H3,(H2,13,16)(H2,14,18,19)