1-(2-chloranyl-5-nitro-phenyl)-3-[2-(dimethylamino)-2-phenyl-ethyl]thiourea

Systemtic Name: 1-(2-chloranyl-5-nitro-phenyl)-3-[2-(dimethylamino)-2-phenyl-ethyl]thiourea Openeye Name: 1-(2-chloro-5-nitro-phenyl)-3-[2-(dimethylamino)-2-phenyl-ethyl]thiourea CAS Name: 1-(2-chloro-5-nitrophenyl)-3-[2-(dimethylamino)-2-phenylethyl]thiourea IUPAC Name: 1-(2-chloro-5-nitrophenyl)-3-[2-(dimethylamino)-2-phenylethyl]thiourea Traditional Name: 1-(2-chloro-5-nitro-phenyl)-3-[2-(dimethylamino)-2-phenyl-ethyl]thiourea Formula: C17H19ClN4O2S MolecularWeight: 378.87636

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(CNC(=S)NC1=C(C=CC(=C1)[N+](=O)[O-])Cl)C2=CC=CC=C2

Isomeric SMILES

CN(C)C(CNC(=S)NC1=C(C=CC(=C1)[N+](=O)[O-])Cl)C2=CC=CC=C2

InChI

InChI=1S/C17H19ClN4O2S/c1-21(2)16(12-6-4-3-5-7-12)11-19-17(25)20-15-10-13(22(23)24)8-9-14(15)18/h3-10,16H,11H2,1-2H3,(H2,19,20,25)