1-[(5S)-5-azanyl-6-azido-hexyl]-3-(2-methylphenyl)urea

Systemtic Name: 1-[(5S)-5-azanyl-6-azido-hexyl]-3-(2-methylphenyl)urea Openeye Name: 1-[(5S)-5-amino-6-azido-hexyl]-3-(o-tolyl)urea CAS Name: 1-[(5S)-5-amino-6-azidohexyl]-3-(2-methylphenyl)urea IUPAC Name: 1-[(5S)-5-amino-6-azidohexyl]-3-(2-methylphenyl)urea Traditional Name: 1-[(5S)-5-amino-6-azido-hexyl]-3-(o-tolyl)urea Formula: C14H22N6O MolecularWeight: 290.36408

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)NCCCCC(CN=[N+]=[N-])N

Isomeric SMILES

CC1=CC=CC=C1NC(=O)NCCCC[C@@H](CN=[N+]=[N-])N

InChI

InChI=1S/C14H22N6O/c1-11-6-2-3-8-13(11)19-14(21)17-9-5-4-7-12(15)10-18-20-16/h2-3,6,8,12H,4-5,7,9-10,15H2,1H3,(H2,17,19,21)/t12-/m0/s1