1-(2-chloranyl-5-nitro-phenyl)-3-[[4-(dimethylaminomethyl)phenyl]methyl]thiourea

Systemtic Name: 1-(2-chloranyl-5-nitro-phenyl)-3-[[4-(dimethylaminomethyl)phenyl]methyl]thiourea Openeye Name: 1-(2-chloro-5-nitro-phenyl)-3-[[4-(dimethylaminomethyl)phenyl]methyl]thiourea CAS Name: 1-(2-chloro-5-nitrophenyl)-3-[[4-(dimethylaminomethyl)phenyl]methyl]thiourea IUPAC Name: 1-(2-chloro-5-nitrophenyl)-3-[[4-(dimethylaminomethyl)phenyl]methyl]thiourea Traditional Name: 1-(2-chloro-5-nitro-phenyl)-3-[4-(dimethylaminomethyl)benzyl]thiourea Formula: C17H19ClN4O2S MolecularWeight: 378.87636

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=CC=C(C=C1)CNC(=S)NC2=C(C=CC(=C2)[N+](=O)[O-])Cl

Isomeric SMILES

CN(C)CC1=CC=C(C=C1)CNC(=S)NC2=C(C=CC(=C2)[N+](=O)[O-])Cl

InChI

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