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

Systemtic Name: (1E)-1-[1-azanyl-4-(pyridin-2-ylmethylsulfanyl)butylidene]urea Openeye Name: (E)-[1-amino-4-(2-pyridylmethylsulfanyl)butylidene]urea CAS Name: (E)-[1-amino-4-(2-pyridinylmethylthio)butylidene]urea IUPAC Name: (E)-[1-amino-4-(pyridin-2-ylmethylsulfanyl)butylidene]urea Traditional Name: (E)-[1-amino-4-(2-pyridylmethylthio)butylidene]urea Formula: C11H16N4OS MolecularWeight: 252.33594

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H16N4OS/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)