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

Systemtic Name: 1-(2-methyl-4-nitro-phenyl)-3-(4-phenoxyphenyl)thiourea Openeye Name: 1-(2-methyl-4-nitro-phenyl)-3-(4-phenoxyphenyl)thiourea CAS Name: 1-(2-methyl-4-nitrophenyl)-3-(4-phenoxyphenyl)thiourea IUPAC Name: 1-(2-methyl-4-nitrophenyl)-3-(4-phenoxyphenyl)thiourea Traditional Name: 1-(2-methyl-4-nitro-phenyl)-3-(4-phenoxyphenyl)thiourea Formula: C20H17N3O3S MolecularWeight: 379.43228

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)[N+](=O)[O-])NC(=S)NC2=CC=C(C=C2)OC3=CC=CC=C3

Isomeric SMILES

CC1=C(C=CC(=C1)[N+](=O)[O-])NC(=S)NC2=CC=C(C=C2)OC3=CC=CC=C3

InChI

InChI=1S/C20H17N3O3S/c1-14-13-16(23(24)25)9-12-19(14)22-20(27)21-15-7-10-18(11-8-15)26-17-5-3-2-4-6-17/h2-13H,1H3,(H2,21,22,27)