1-[(1S,2S)-2-methylcyclohexyl]-3-[(1S)-1-(4-methylsulfonylphenyl)ethyl]thiourea

Systemtic Name: 1-[(1S,2S)-2-methylcyclohexyl]-3-[(1S)-1-(4-methylsulfonylphenyl)ethyl]thiourea Openeye Name: 1-[(1S,2S)-2-methylcyclohexyl]-3-[(1S)-1-(4-methylsulfonylphenyl)ethyl]thiourea CAS Name: 1-[(1S,2S)-2-methylcyclohexyl]-3-[(1S)-1-(4-methylsulfonylphenyl)ethyl]thiourea IUPAC Name: 1-[(1S,2S)-2-methylcyclohexyl]-3-[(1S)-1-(4-methylsulfonylphenyl)ethyl]thiourea Traditional Name: 1-[(1S)-1-(4-mesylphenyl)ethyl]-3-[(1S,2S)-2-methylcyclohexyl]thiourea Formula: C17H26N2O2S2 MolecularWeight: 354.53054

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=S)NC(C)C2=CC=C(C=C2)S(=O)(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C17H26N2O2S2/c1-12-6-4-5-7-16(12)19-17(22)18-13(2)14-8-10-15(11-9-14)23(3,20)21/h8-13,16H,4-7H2,1-3H3,(H2,18,19,22)/t12-,13-,16-/m0/s1