1-(2-methoxy-4-nitro-phenyl)-3-[2-(phenylcarbonyl)phenyl]thiourea

Systemtic Name: 1-(2-methoxy-4-nitro-phenyl)-3-[2-(phenylcarbonyl)phenyl]thiourea Openeye Name: 1-(2-benzoylphenyl)-3-(2-methoxy-4-nitro-phenyl)thiourea CAS Name: 1-(2-benzoylphenyl)-3-(2-methoxy-4-nitrophenyl)thiourea IUPAC Name: 1-(2-benzoylphenyl)-3-(2-methoxy-4-nitrophenyl)thiourea Traditional Name: 1-(2-benzoylphenyl)-3-(2-methoxy-4-nitro-phenyl)thiourea Formula: C21H17N3O4S MolecularWeight: 407.44238

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=S)NC2=CC=CC=C2C(=O)C3=CC=CC=C3

Isomeric SMILES

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=S)NC2=CC=CC=C2C(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H17N3O4S/c1-28-19-13-15(24(26)27)11-12-18(19)23-21(29)22-17-10-6-5-9-16(17)20(25)14-7-3-2-4-8-14/h2-13H,1H3,(H2,22,23,29)