1-(5-methoxy-2-methyl-4-nitro-phenyl)-3-(4-phenoxyphenyl)thiourea

Systemtic Name: 1-(5-methoxy-2-methyl-4-nitro-phenyl)-3-(4-phenoxyphenyl)thiourea Openeye Name: 1-(5-methoxy-2-methyl-4-nitro-phenyl)-3-(4-phenoxyphenyl)thiourea CAS Name: 1-(5-methoxy-2-methyl-4-nitrophenyl)-3-(4-phenoxyphenyl)thiourea IUPAC Name: 1-(5-methoxy-2-methyl-4-nitrophenyl)-3-(4-phenoxyphenyl)thiourea Traditional Name: 1-(5-methoxy-2-methyl-4-nitro-phenyl)-3-(4-phenoxyphenyl)thiourea Formula: C21H19N3O4S MolecularWeight: 409.45826

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1NC(=S)NC2=CC=C(C=C2)OC3=CC=CC=C3)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1NC(=S)NC2=CC=C(C=C2)OC3=CC=CC=C3)OC)[N+](=O)[O-]

InChI

InChI=1S/C21H19N3O4S/c1-14-12-19(24(25)26)20(27-2)13-18(14)23-21(29)22-15-8-10-17(11-9-15)28-16-6-4-3-5-7-16/h3-13H,1-2H3,(H2,22,23,29)