1-(4-chlorophenyl)-3-[[4-(methylamino)-3-nitro-phenyl]carbonylamino]thiourea

Systemtic Name: 1-(4-chlorophenyl)-3-[[4-(methylamino)-3-nitro-phenyl]carbonylamino]thiourea Openeye Name: 1-(4-chlorophenyl)-3-[[4-(methylamino)-3-nitro-benzoyl]amino]thiourea CAS Name: 1-(4-chlorophenyl)-3-[[[4-(methylamino)-3-nitrophenyl]-oxomethyl]amino]thiourea IUPAC Name: 1-(4-chlorophenyl)-3-[[4-(methylamino)-3-nitrobenzoyl]amino]thiourea Traditional Name: 1-(4-chlorophenyl)-3-[[4-(methylamino)-3-nitro-benzoyl]amino]thiourea Formula: C15H14ClN5O3S MolecularWeight: 379.82136

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=C(C=C1)C(=O)NNC(=S)NC2=CC=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CNC1=C(C=C(C=C1)C(=O)NNC(=S)NC2=CC=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C15H14ClN5O3S/c1-17-12-7-2-9(8-13(12)21(23)24)14(22)19-20-15(25)18-11-5-3-10(16)4-6-11/h2-8,17H,1H3,(H,19,22)(H2,18,20,25)