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

Systemtic Name: 1-tert-butyl-3-(4-methyl-2-nitro-phenyl)thiourea Openeye Name: 1-tert-butyl-3-(4-methyl-2-nitro-phenyl)thiourea CAS Name: 1-tert-butyl-3-(4-methyl-2-nitrophenyl)thiourea IUPAC Name: 1-tert-butyl-3-(4-methyl-2-nitrophenyl)thiourea Traditional Name: 1-tert-butyl-3-(4-methyl-2-nitro-phenyl)thiourea Formula: C12H17N3O2S MolecularWeight: 267.34728

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=S)NC(C)(C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=S)NC(C)(C)C)[N+](=O)[O-]

InChI

InChI=1S/C12H17N3O2S/c1-8-5-6-9(10(7-8)15(16)17)13-11(18)14-12(2,3)4/h5-7H,1-4H3,(H2,13,14,18)