1-[(1S)-1-(2,5-dimethylphenyl)ethyl]-3-(4-nitrophenyl)thiourea

Systemtic Name: 1-[(1S)-1-(2,5-dimethylphenyl)ethyl]-3-(4-nitrophenyl)thiourea Openeye Name: 1-[(1S)-1-(2,5-dimethylphenyl)ethyl]-3-(4-nitrophenyl)thiourea CAS Name: 1-[(1S)-1-(2,5-dimethylphenyl)ethyl]-3-(4-nitrophenyl)thiourea IUPAC Name: 1-[(1S)-1-(2,5-dimethylphenyl)ethyl]-3-(4-nitrophenyl)thiourea Traditional Name: 1-[(1S)-1-(2,5-dimethylphenyl)ethyl]-3-(4-nitrophenyl)thiourea Formula: C17H19N3O2S MolecularWeight: 329.41666

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19N3O2S/c1-11-4-5-12(2)16(10-11)13(3)18-17(23)19-14-6-8-15(9-7-14)20(21)22/h4-10,13H,1-3H3,(H2,18,19,23)/t13-/m0/s1