1-[1-(4-cyanobutyl)pyrazol-3-yl]-3-propylsulfanyl-urea

Systemtic Name: 1-[1-(4-cyanobutyl)pyrazol-3-yl]-3-propylsulfanyl-urea Openeye Name: 1-[1-(4-cyanobutyl)pyrazol-3-yl]-3-propylsulfanyl-urea CAS Name: 1-[1-(4-cyanobutyl)-3-pyrazolyl]-3-(propylthio)urea IUPAC Name: 1-[1-(4-cyanobutyl)pyrazol-3-yl]-3-propylsulfanylurea Traditional Name: 1-[1-(4-cyanobutyl)pyrazol-3-yl]-3-(propylthio)urea Formula: C12H19N5OS MolecularWeight: 281.37716

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Descriptors Computed from Structure

Canonical SMILES:

CCCSNC(=O)NC1=NN(C=C1)CCCCC#N

Isomeric SMILES

CCCSNC(=O)NC1=NN(C=C1)CCCCC#N

InChI

InChI=1S/C12H19N5OS/c1-2-10-19-16-12(18)14-11-6-9-17(15-11)8-5-3-4-7-13/h6,9H,2-5,8,10H2,1H3,(H2,14,15,16,18)