1-(2-chloranyl-4-nitro-phenyl)-3-(2,6-diethylphenyl)thiourea

Systemtic Name: 1-(2-chloranyl-4-nitro-phenyl)-3-(2,6-diethylphenyl)thiourea Openeye Name: 1-(2-chloro-4-nitro-phenyl)-3-(2,6-diethylphenyl)thiourea CAS Name: 1-(2-chloro-4-nitrophenyl)-3-(2,6-diethylphenyl)thiourea IUPAC Name: 1-(2-chloro-4-nitrophenyl)-3-(2,6-diethylphenyl)thiourea Traditional Name: 1-(2-chloro-4-nitro-phenyl)-3-(2,6-diethylphenyl)thiourea Formula: C17H18ClN3O2S MolecularWeight: 363.86172

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=S)NC2=C(C=C(C=C2)[N+](=O)[O-])Cl

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=S)NC2=C(C=C(C=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C17H18ClN3O2S/c1-3-11-6-5-7-12(4-2)16(11)20-17(24)19-15-9-8-13(21(22)23)10-14(15)18/h5-10H,3-4H2,1-2H3,(H2,19,20,24)