1-(2-methyl-5-nitro-phenyl)-3-phenyl-thiourea

Systemtic Name: 1-(2-methyl-5-nitro-phenyl)-3-phenyl-thiourea Openeye Name: 1-(2-methyl-5-nitro-phenyl)-3-phenyl-thiourea CAS Name: 1-(2-methyl-5-nitrophenyl)-3-phenylthiourea IUPAC Name: 1-(2-methyl-5-nitrophenyl)-3-phenylthiourea Traditional Name: 1-(2-methyl-5-nitro-phenyl)-3-phenyl-thiourea Formula: C14H13N3O2S MolecularWeight: 287.33692

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H13N3O2S/c1-10-7-8-12(17(18)19)9-13(10)16-14(20)15-11-5-3-2-4-6-11/h2-9H,1H3,(H2,15,16,20)