1-[(1S,2S)-2-methylcyclohexyl]-3-[[2-(2-phenoxyethoxy)phenyl]carbonylamino]thiourea

Systemtic Name: 1-[(1S,2S)-2-methylcyclohexyl]-3-[[2-(2-phenoxyethoxy)phenyl]carbonylamino]thiourea Openeye Name: 1-[(1S,2S)-2-methylcyclohexyl]-3-[[2-(2-phenoxyethoxy)benzoyl]amino]thiourea CAS Name: 1-[(1S,2S)-2-methylcyclohexyl]-3-[[oxo-[2-(2-phenoxyethoxy)phenyl]methyl]amino]thiourea IUPAC Name: 1-[(1S,2S)-2-methylcyclohexyl]-3-[[2-(2-phenoxyethoxy)benzoyl]amino]thiourea Traditional Name: 1-[(1S,2S)-2-methylcyclohexyl]-3-[[2-(2-phenoxyethoxy)benzoyl]amino]thiourea Formula: C23H29N3O3S MolecularWeight: 427.55966

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=S)NNC(=O)C2=CC=CC=C2OCCOC3=CC=CC=C3

Isomeric SMILES

C[C@H]1CCCC[C@@H]1NC(=S)NNC(=O)C2=CC=CC=C2OCCOC3=CC=CC=C3

InChI

InChI=1S/C23H29N3O3S/c1-17-9-5-7-13-20(17)24-23(30)26-25-22(27)19-12-6-8-14-21(19)29-16-15-28-18-10-3-2-4-11-18/h2-4,6,8,10-12,14,17,20H,5,7,9,13,15-16H2,1H3,(H,25,27)(H2,24,26,30)/t17-,20-/m0/s1