1,1-dibutyl-3-(2-chloranyl-5-nitro-phenyl)thiourea

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H22ClN3O2S/c1-3-5-9-18(10-6-4-2)15(22)17-14-11-12(19(20)21)7-8-13(14)16/h7-8,11H,3-6,9-10H2,1-2H3,(H,17,22)