(3E)-1-(5-butan-2-ylpyridin-2-yl)-3-(2-chloroethylcarbamoylimino)urea

Systemtic Name: (3E)-1-(5-butan-2-ylpyridin-2-yl)-3-(2-chloroethylcarbamoylimino)urea Openeye Name: (3E)-1-(2-chloroethyl)-3-[(5-sec-butyl-2-pyridyl)carbamoylimino]urea CAS Name: (3E)-1-(5-butan-2-yl-2-pyridinyl)-3-[(2-chloroethylamino)-oxomethyl]iminourea IUPAC Name: (3E)-1-(5-butan-2-ylpyridin-2-yl)-3-(2-chloroethylcarbamoylimino)urea Traditional Name: (3E)-1-(2-chloroethyl)-3-[(5-sec-butyl-2-pyridyl)carbamoylimino]urea Formula: C13H18ClN5O2 MolecularWeight: 311.76732

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CN=C(C=C1)NC(=O)N=NC(=O)NCCCl

Isomeric SMILES

CCC(C)C1=CN=C(C=C1)NC(=O)/N=N/C(=O)NCCCl

InChI

InChI=1S/C13H18ClN5O2/c1-3-9(2)10-4-5-11(16-8-10)17-13(21)19-18-12(20)15-7-6-14/h4-5,8-9H,3,6-7H2,1-2H3,(H,15,20)(H,16,17,21)/b19-18+