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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1=C(C=C(C=C1)C)Cl)C(=O)N=C(N)N

Isomeric SMILES

CCCCN(C1=C(C=C(C=C1)C)Cl)C(=O)N=C(N)N

InChI

InChI=1S/C13H19ClN4O/c1-3-4-7-18(13(19)17-12(15)16)11-6-5-9(2)8-10(11)14/h5-6,8H,3-4,7H2,1-2H3,(H4,15,16,17,19)