1-butyl-3-[4-(1H-imidazol-5-yl)butylsulfanyl]urea

Systemtic Name: 1-butyl-3-[4-(1H-imidazol-5-yl)butylsulfanyl]urea Openeye Name: 1-butyl-3-[4-(1H-imidazol-5-yl)butylsulfanyl]urea CAS Name: 1-butyl-3-[4-(1H-imidazol-5-yl)butylthio]urea IUPAC Name: 1-butyl-3-[4-(1H-imidazol-5-yl)butylsulfanyl]urea Traditional Name: 1-butyl-3-[4-(1H-imidazol-5-yl)butylthio]urea Formula: C12H22N4OS MolecularWeight: 270.39428

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NSCCCCC1=CN=CN1

Isomeric SMILES

CCCCNC(=O)NSCCCCC1=CN=CN1

InChI

InChI=1S/C12H22N4OS/c1-2-3-7-14-12(17)16-18-8-5-4-6-11-9-13-10-15-11/h9-10H,2-8H2,1H3,(H,13,15)(H2,14,16,17)