1-(2,6-dimethylphenyl)-3-(4-methyl-2-nitro-phenyl)thiourea

Systemtic Name: 1-(2,6-dimethylphenyl)-3-(4-methyl-2-nitro-phenyl)thiourea Openeye Name: 1-(2,6-dimethylphenyl)-3-(4-methyl-2-nitro-phenyl)thiourea CAS Name: 1-(2,6-dimethylphenyl)-3-(4-methyl-2-nitrophenyl)thiourea IUPAC Name: 1-(2,6-dimethylphenyl)-3-(4-methyl-2-nitrophenyl)thiourea Traditional Name: 1-(2,6-dimethylphenyl)-3-(4-methyl-2-nitro-phenyl)thiourea Formula: C16H17N3O2S MolecularWeight: 315.39008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=S)NC2=C(C=CC=C2C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=S)NC2=C(C=CC=C2C)C)[N+](=O)[O-]

InChI

InChI=1S/C16H17N3O2S/c1-10-7-8-13(14(9-10)19(20)21)17-16(22)18-15-11(2)5-4-6-12(15)3/h4-9H,1-3H3,(H2,17,18,22)