1-butyl-3-[3-(methylamino)-2,2-bis(methylaminomethyl)propyl]urea

Systemtic Name: 1-butyl-3-[3-(methylamino)-2,2-bis(methylaminomethyl)propyl]urea Openeye Name: 1-butyl-3-[3-(methylamino)-2,2-bis(methylaminomethyl)propyl]urea CAS Name: 1-butyl-3-[3-(methylamino)-2,2-bis(methylaminomethyl)propyl]urea IUPAC Name: 1-butyl-3-[3-(methylamino)-2,2-bis(methylaminomethyl)propyl]urea Traditional Name: 1-butyl-3-[3-(methylamino)-2,2-bis(methylaminomethyl)propyl]urea Formula: C13H31N5O MolecularWeight: 273.41814

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NCC(CNC)(CNC)CNC

Isomeric SMILES

CCCCNC(=O)NCC(CNC)(CNC)CNC

InChI

InChI=1S/C13H31N5O/c1-5-6-7-17-12(19)18-11-13(8-14-2,9-15-3)10-16-4/h14-16H,5-11H2,1-4H3,(H2,17,18,19)