1-(3-nitrophenyl)-3-(2,4,4-trimethylpentan-2-yl)thiourea

Systemtic Name: 1-(3-nitrophenyl)-3-(2,4,4-trimethylpentan-2-yl)thiourea Openeye Name: 1-(3-nitrophenyl)-3-(1,1,3,3-tetramethylbutyl)thiourea CAS Name: 1-(3-nitrophenyl)-3-(2,4,4-trimethylpentan-2-yl)thiourea IUPAC Name: 1-(3-nitrophenyl)-3-(2,4,4-trimethylpentan-2-yl)thiourea Traditional Name: 1-(3-nitrophenyl)-3-(1,1,3,3-tetramethylbutyl)thiourea Formula: C15H23N3O2S MolecularWeight: 309.42702

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H23N3O2S/c1-14(2,3)10-15(4,5)17-13(21)16-11-7-6-8-12(9-11)18(19)20/h6-9H,10H2,1-5H3,(H2,16,17,21)