1-(2,3-dimethyl-6-nitro-phenyl)-3-phenyl-thiourea

Systemtic Name: 1-(2,3-dimethyl-6-nitro-phenyl)-3-phenyl-thiourea Openeye Name: 1-(2,3-dimethyl-6-nitro-phenyl)-3-phenyl-thiourea CAS Name: 1-(2,3-dimethyl-6-nitrophenyl)-3-phenylthiourea IUPAC Name: 1-(2,3-dimethyl-6-nitrophenyl)-3-phenylthiourea Traditional Name: 1-(2,3-dimethyl-6-nitro-phenyl)-3-phenyl-thiourea Formula: C15H15N3O2S MolecularWeight: 301.3635

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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)C

Isomeric SMILES

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

InChI

InChI=1S/C15H15N3O2S/c1-10-8-9-13(18(19)20)14(11(10)2)17-15(21)16-12-6-4-3-5-7-12/h3-9H,1-2H3,(H2,16,17,21)