1-tert-butyl-3-[(3-nitrophenyl)carbonylamino]thiourea

Systemtic Name: 1-tert-butyl-3-[(3-nitrophenyl)carbonylamino]thiourea Openeye Name: 1-tert-butyl-3-[(3-nitrobenzoyl)amino]thiourea CAS Name: 1-tert-butyl-3-[[(3-nitrophenyl)-oxomethyl]amino]thiourea IUPAC Name: 1-tert-butyl-3-[(3-nitrobenzoyl)amino]thiourea Traditional Name: 1-tert-butyl-3-[(3-nitrobenzoyl)amino]thiourea Formula: C12H16N4O3S MolecularWeight: 296.34544

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H16N4O3S/c1-12(2,3)13-11(20)15-14-10(17)8-5-4-6-9(7-8)16(18)19/h4-7H,1-3H3,(H,14,17)(H2,13,15,20)