1-[3-[bis(azanyl)methylideneamino]phenyl]-3-octyl-urea

Systemtic Name: 1-[3-[bis(azanyl)methylideneamino]phenyl]-3-octyl-urea Openeye Name: 1-(3-guanidinophenyl)-3-octyl-urea CAS Name: 1-[3-(diaminomethylideneamino)phenyl]-3-octylurea IUPAC Name: 1-[3-(diaminomethylideneamino)phenyl]-3-octylurea Traditional Name: 1-(3-guanidinophenyl)-3-octyl-urea Formula: C16H27N5O MolecularWeight: 305.41848

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNC(=O)NC1=CC=CC(=C1)N=C(N)N

Isomeric SMILES

CCCCCCCCNC(=O)NC1=CC=CC(=C1)N=C(N)N

InChI

InChI=1S/C16H27N5O/c1-2-3-4-5-6-7-11-19-16(22)21-14-10-8-9-13(12-14)20-15(17)18/h8-10,12H,2-7,11H2,1H3,(H4,17,18,20)(H2,19,21,22)