3-(2-chloranyl-5-nitro-phenyl)-1-[(2,4-dimethylphenyl)methyl]-1-methyl-thiourea

Systemtic Name: 3-(2-chloranyl-5-nitro-phenyl)-1-[(2,4-dimethylphenyl)methyl]-1-methyl-thiourea Openeye Name: 3-(2-chloro-5-nitro-phenyl)-1-[(2,4-dimethylphenyl)methyl]-1-methyl-thiourea CAS Name: 3-(2-chloro-5-nitrophenyl)-1-[(2,4-dimethylphenyl)methyl]-1-methylthiourea IUPAC Name: 3-(2-chloro-5-nitrophenyl)-1-[(2,4-dimethylphenyl)methyl]-1-methylthiourea Traditional Name: 3-(2-chloro-5-nitro-phenyl)-1-(2,4-dimethylbenzyl)-1-methyl-thiourea Formula: C17H18ClN3O2S MolecularWeight: 363.86172

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18ClN3O2S/c1-11-4-5-13(12(2)8-11)10-20(3)17(24)19-16-9-14(21(22)23)6-7-15(16)18/h4-9H,10H2,1-3H3,(H,19,24)