1-tert-butyl-3-[(2-chloranyl-4-nitro-phenyl)carbonylamino]thiourea

Systemtic Name: 1-tert-butyl-3-[(2-chloranyl-4-nitro-phenyl)carbonylamino]thiourea Openeye Name: 1-tert-butyl-3-[(2-chloro-4-nitro-benzoyl)amino]thiourea CAS Name: 1-tert-butyl-3-[[(2-chloro-4-nitrophenyl)-oxomethyl]amino]thiourea IUPAC Name: 1-tert-butyl-3-[(2-chloro-4-nitrobenzoyl)amino]thiourea Traditional Name: 1-tert-butyl-3-[(2-chloro-4-nitro-benzoyl)amino]thiourea Formula: C12H15ClN4O3S MolecularWeight: 330.7905

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=S)NNC(=O)C1=C(C=C(C=C1)[N+](=O)[O-])Cl

Isomeric SMILES

CC(C)(C)NC(=S)NNC(=O)C1=C(C=C(C=C1)[N+](=O)[O-])Cl

InChI

InChI=1S/C12H15ClN4O3S/c1-12(2,3)14-11(21)16-15-10(18)8-5-4-7(17(19)20)6-9(8)13/h4-6H,1-3H3,(H,15,18)(H2,14,16,21)