1-(3,3-dimethylbutan-2-yl)-3-(2-methoxy-4-nitro-phenyl)thiourea

Systemtic Name: 1-(3,3-dimethylbutan-2-yl)-3-(2-methoxy-4-nitro-phenyl)thiourea Openeye Name: 1-(2-methoxy-4-nitro-phenyl)-3-(1,2,2-trimethylpropyl)thiourea CAS Name: 1-(3,3-dimethylbutan-2-yl)-3-(2-methoxy-4-nitrophenyl)thiourea IUPAC Name: 1-(3,3-dimethylbutan-2-yl)-3-(2-methoxy-4-nitrophenyl)thiourea Traditional Name: 1-(2-methoxy-4-nitro-phenyl)-3-(1,2,2-trimethylpropyl)thiourea Formula: C14H21N3O3S MolecularWeight: 311.39984

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H21N3O3S/c1-9(14(2,3)4)15-13(21)16-11-7-6-10(17(18)19)8-12(11)20-5/h6-9H,1-5H3,(H2,15,16,21)