1-[bis(azanyl)methylidene]-3-(2-butyl-6-chloranyl-phenyl)thiourea

Systemtic Name: 1-[bis(azanyl)methylidene]-3-(2-butyl-6-chloranyl-phenyl)thiourea Openeye Name: 1-(2-butyl-6-chloro-phenyl)-3-(diaminomethylene)thiourea CAS Name: 1-(2-butyl-6-chlorophenyl)-3-(diaminomethylidene)thiourea IUPAC Name: 1-(2-butyl-6-chlorophenyl)-3-(diaminomethylidene)thiourea Traditional Name: 1-(2-butyl-6-chloro-phenyl)-3-(diaminomethylene)thiourea Formula: C12H17ClN4S MolecularWeight: 284.80818

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(=CC=C1)Cl)NC(=S)N=C(N)N

Isomeric SMILES

CCCCC1=C(C(=CC=C1)Cl)NC(=S)N=C(N)N

InChI

InChI=1S/C12H17ClN4S/c1-2-3-5-8-6-4-7-9(13)10(8)16-12(18)17-11(14)15/h4,6-7H,2-3,5H2,1H3,(H5,14,15,16,17,18)