1-tert-butyl-3-(4-methoxy-2-nitro-phenyl)thiourea

Systemtic Name: 1-tert-butyl-3-(4-methoxy-2-nitro-phenyl)thiourea Openeye Name: 1-tert-butyl-3-(4-methoxy-2-nitro-phenyl)thiourea CAS Name: 1-tert-butyl-3-(4-methoxy-2-nitrophenyl)thiourea IUPAC Name: 1-tert-butyl-3-(4-methoxy-2-nitrophenyl)thiourea Traditional Name: 1-tert-butyl-3-(4-methoxy-2-nitro-phenyl)thiourea Formula: C12H17N3O3S MolecularWeight: 283.34668

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=S)NC1=C(C=C(C=C1)OC)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)NC(=S)NC1=C(C=C(C=C1)OC)[N+](=O)[O-]

InChI

InChI=1S/C12H17N3O3S/c1-12(2,3)14-11(19)13-9-6-5-8(18-4)7-10(9)15(16)17/h5-7H,1-4H3,(H2,13,14,19)