1-(3-chlorophenyl)-3-[[2-(dimethylamino)-5-nitro-phenyl]carbonylamino]thiourea

Systemtic Name: 1-(3-chlorophenyl)-3-[[2-(dimethylamino)-5-nitro-phenyl]carbonylamino]thiourea Openeye Name: 1-(3-chlorophenyl)-3-[[2-(dimethylamino)-5-nitro-benzoyl]amino]thiourea CAS Name: 1-(3-chlorophenyl)-3-[[[2-(dimethylamino)-5-nitrophenyl]-oxomethyl]amino]thiourea IUPAC Name: 1-(3-chlorophenyl)-3-[[2-(dimethylamino)-5-nitrobenzoyl]amino]thiourea Traditional Name: 1-(3-chlorophenyl)-3-[[2-(dimethylamino)-5-nitro-benzoyl]amino]thiourea Formula: C16H16ClN5O3S MolecularWeight: 393.84794

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H16ClN5O3S/c1-21(2)14-7-6-12(22(24)25)9-13(14)15(23)19-20-16(26)18-11-5-3-4-10(17)8-11/h3-9H,1-2H3,(H,19,23)(H2,18,20,26)