1-[bis(azanyl)methylidene]-3-(2-chloranyl-4-pentyl-phenyl)urea

Systemtic Name: 1-[bis(azanyl)methylidene]-3-(2-chloranyl-4-pentyl-phenyl)urea Openeye Name: 1-(2-chloro-4-pentyl-phenyl)-3-(diaminomethylene)urea CAS Name: 1-(2-chloro-4-pentylphenyl)-3-(diaminomethylidene)urea IUPAC Name: 1-(2-chloro-4-pentylphenyl)-3-(diaminomethylidene)urea Traditional Name: 1-(4-amyl-2-chloro-phenyl)-3-(diaminomethylene)urea Formula: C13H19ClN4O MolecularWeight: 282.76916

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC(=C(C=C1)NC(=O)N=C(N)N)Cl

Isomeric SMILES

CCCCCC1=CC(=C(C=C1)NC(=O)N=C(N)N)Cl

InChI

InChI=1S/C13H19ClN4O/c1-2-3-4-5-9-6-7-11(10(14)8-9)17-13(19)18-12(15)16/h6-8H,2-5H2,1H3,(H5,15,16,17,18,19)