(1E)-1-[1-azanyl-4-(pyridin-2-ylmethylsulfanyl)butylidene]urea dihydrochloride

Systemtic Name: (1E)-1-[1-azanyl-4-(pyridin-2-ylmethylsulfanyl)butylidene]urea dihydrochloride Openeye Name: (E)-[1-amino-4-(2-pyridylmethylsulfanyl)butylidene]urea dihydrochloride CAS Name: (E)-[1-amino-4-(2-pyridinylmethylthio)butylidene]urea dihydrochloride IUPAC Name: (E)-[1-amino-4-(pyridin-2-ylmethylsulfanyl)butylidene]urea dihydrochloride Traditional Name: (E)-[1-amino-4-(2-pyridylmethylthio)butylidene]urea dihydrochloride Formula: C11H18Cl2N4OS MolecularWeight: 325.25782

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)CSCCCC(=NC(=O)N)N.Cl.Cl

Isomeric SMILES

C1=CC=NC(=C1)CSCCC/C(=N\C(=O)N)/N.Cl.Cl

InChI

InChI=1S/C11H16N4OS.2ClH/c12-10(15-11(13)16)5-3-7-17-8-9-4-1-2-6-14-9;;/h1-2,4,6H,3,5,7-8H2,(H4,12,13,15,16);2*1H