1-(2-methoxy-4-nitro-phenyl)-3-(4-phenylmethoxyphenyl)thiourea

Systemtic Name: 1-(2-methoxy-4-nitro-phenyl)-3-(4-phenylmethoxyphenyl)thiourea Openeye Name: 1-(4-benzyloxyphenyl)-3-(2-methoxy-4-nitro-phenyl)thiourea CAS Name: 1-(2-methoxy-4-nitrophenyl)-3-(4-phenylmethoxyphenyl)thiourea IUPAC Name: 1-(2-methoxy-4-nitrophenyl)-3-(4-phenylmethoxyphenyl)thiourea Traditional Name: 1-(4-benzoxyphenyl)-3-(2-methoxy-4-nitro-phenyl)thiourea Formula: C21H19N3O4S MolecularWeight: 409.45826

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=S)NC2=CC=C(C=C2)OCC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=S)NC2=CC=C(C=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C21H19N3O4S/c1-27-20-13-17(24(25)26)9-12-19(20)23-21(29)22-16-7-10-18(11-8-16)28-14-15-5-3-2-4-6-15/h2-13H,14H2,1H3,(H2,22,23,29)