1-(2-chloranyl-5-nitro-phenyl)-3-(2,4,4-trimethylpentan-2-yl)thiourea

Systemtic Name: 1-(2-chloranyl-5-nitro-phenyl)-3-(2,4,4-trimethylpentan-2-yl)thiourea Openeye Name: 1-(2-chloro-5-nitro-phenyl)-3-(1,1,3,3-tetramethylbutyl)thiourea CAS Name: 1-(2-chloro-5-nitrophenyl)-3-(2,4,4-trimethylpentan-2-yl)thiourea IUPAC Name: 1-(2-chloro-5-nitrophenyl)-3-(2,4,4-trimethylpentan-2-yl)thiourea Traditional Name: 1-(2-chloro-5-nitro-phenyl)-3-(1,1,3,3-tetramethylbutyl)thiourea Formula: C15H22ClN3O2S MolecularWeight: 343.87208

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H22ClN3O2S/c1-14(2,3)9-15(4,5)18-13(22)17-12-8-10(19(20)21)6-7-11(12)16/h6-8H,9H2,1-5H3,(H2,17,18,22)