1-butyl-3-[(5-chloranyl-2-oxidanyl-phenyl)carbonylamino]thiourea

Systemtic Name: 1-butyl-3-[(5-chloranyl-2-oxidanyl-phenyl)carbonylamino]thiourea Openeye Name: 1-butyl-3-[(5-chloro-2-hydroxy-benzoyl)amino]thiourea CAS Name: 1-butyl-3-[[(5-chloro-2-hydroxyphenyl)-oxomethyl]amino]thiourea IUPAC Name: 1-butyl-3-[(5-chloro-2-hydroxybenzoyl)amino]thiourea Traditional Name: 1-butyl-3-[(5-chloro-2-hydroxy-benzoyl)amino]thiourea Formula: C12H16ClN3O2S MolecularWeight: 301.79234

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)NNC(=O)C1=C(C=CC(=C1)Cl)O

Isomeric SMILES

CCCCNC(=S)NNC(=O)C1=C(C=CC(=C1)Cl)O

InChI

InChI=1S/C12H16ClN3O2S/c1-2-3-6-14-12(19)16-15-11(18)9-7-8(13)4-5-10(9)17/h4-5,7,17H,2-3,6H2,1H3,(H,15,18)(H2,14,16,19)