1-(2-azanylbutanoylamino)-3-[(2-bromophenyl)methyl]urea

Systemtic Name: 1-(2-azanylbutanoylamino)-3-[(2-bromophenyl)methyl]urea Openeye Name: 1-(2-aminobutanoylamino)-3-[(2-bromophenyl)methyl]urea CAS Name: 1-[(2-amino-1-oxobutyl)amino]-3-[(2-bromophenyl)methyl]urea IUPAC Name: 1-(2-aminobutanoylamino)-3-[(2-bromophenyl)methyl]urea Traditional Name: 1-(2-aminobutanoylamino)-3-(2-bromobenzyl)urea Formula: C12H17BrN4O2 MolecularWeight: 329.19298

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NNC(=O)NCC1=CC=CC=C1Br)N

Isomeric SMILES

CCC(C(=O)NNC(=O)NCC1=CC=CC=C1Br)N

InChI

InChI=1S/C12H17BrN4O2/c1-2-10(14)11(18)16-17-12(19)15-7-8-5-3-4-6-9(8)13/h3-6,10H,2,7,14H2,1H3,(H,16,18)(H2,15,17,19)