1-[(1S,2S)-2-methylcyclohexyl]-3-(2-methyl-5-nitro-phenyl)thiourea

Systemtic Name: 1-[(1S,2S)-2-methylcyclohexyl]-3-(2-methyl-5-nitro-phenyl)thiourea Openeye Name: 1-[(1S,2S)-2-methylcyclohexyl]-3-(2-methyl-5-nitro-phenyl)thiourea CAS Name: 1-[(1S,2S)-2-methylcyclohexyl]-3-(2-methyl-5-nitrophenyl)thiourea IUPAC Name: 1-[(1S,2S)-2-methylcyclohexyl]-3-(2-methyl-5-nitrophenyl)thiourea Traditional Name: 1-[(1S,2S)-2-methylcyclohexyl]-3-(2-methyl-5-nitro-phenyl)thiourea Formula: C15H21N3O2S MolecularWeight: 307.41114

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=S)NC2=C(C=CC(=C2)[N+](=O)[O-])C

Isomeric SMILES

C[C@H]1CCCC[C@@H]1NC(=S)NC2=C(C=CC(=C2)[N+](=O)[O-])C

InChI

InChI=1S/C15H21N3O2S/c1-10-5-3-4-6-13(10)16-15(21)17-14-9-12(18(19)20)8-7-11(14)2/h7-10,13H,3-6H2,1-2H3,(H2,16,17,21)/t10-,13-/m0/s1