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

Systemtic Name: 1-tert-butyl-3-[(5-chloranyl-2-methoxy-phenyl)carbonylamino]thiourea Openeye Name: 1-tert-butyl-3-[(5-chloro-2-methoxy-benzoyl)amino]thiourea CAS Name: 1-tert-butyl-3-[[(5-chloro-2-methoxyphenyl)-oxomethyl]amino]thiourea IUPAC Name: 1-tert-butyl-3-[(5-chloro-2-methoxybenzoyl)amino]thiourea Traditional Name: 1-tert-butyl-3-[(5-chloro-2-methoxy-benzoyl)amino]thiourea Formula: C13H18ClN3O2S MolecularWeight: 315.81892

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=S)NNC(=O)C1=C(C=CC(=C1)Cl)OC

Isomeric SMILES

CC(C)(C)NC(=S)NNC(=O)C1=C(C=CC(=C1)Cl)OC

InChI

InChI=1S/C13H18ClN3O2S/c1-13(2,3)15-12(20)17-16-11(18)9-7-8(14)5-6-10(9)19-4/h5-7H,1-4H3,(H,16,18)(H2,15,17,20)