1,1-dimethyl-3-(3-nitro-4-phenethyloxy-phenyl)thiourea

Systemtic Name: 1,1-dimethyl-3-(3-nitro-4-phenethyloxy-phenyl)thiourea Openeye Name: 1,1-dimethyl-3-(3-nitro-4-phenethyloxy-phenyl)thiourea CAS Name: 1,1-dimethyl-3-(3-nitro-4-phenethyloxyphenyl)thiourea IUPAC Name: 1,1-dimethyl-3-(3-nitro-4-phenethyloxyphenyl)thiourea Traditional Name: 1,1-dimethyl-3-(3-nitro-4-phenethyloxy-phenyl)thiourea Formula: C17H19N3O3S MolecularWeight: 345.41606

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=S)NC1=CC(=C(C=C1)OCCC2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CN(C)C(=S)NC1=CC(=C(C=C1)OCCC2=CC=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H19N3O3S/c1-19(2)17(24)18-14-8-9-16(15(12-14)20(21)22)23-11-10-13-6-4-3-5-7-13/h3-9,12H,10-11H2,1-2H3,(H,18,24)