1-cyclohexyl-3-[(2R)-2-(4-methoxyphenyl)-2-morpholin-4-ium-4-yl-ethyl]thiourea

Systemtic Name: 1-cyclohexyl-3-[(2R)-2-(4-methoxyphenyl)-2-morpholin-4-ium-4-yl-ethyl]thiourea Openeye Name: 1-cyclohexyl-3-[(2R)-2-(4-methoxyphenyl)-2-morpholin-4-ium-4-yl-ethyl]thiourea CAS Name: 1-cyclohexyl-3-[(2R)-2-(4-methoxyphenyl)-2-(4-morpholin-4-iumyl)ethyl]thiourea IUPAC Name: 1-cyclohexyl-3-[(2R)-2-(4-methoxyphenyl)-2-morpholin-4-ium-4-ylethyl]thiourea Traditional Name: 1-cyclohexyl-3-[(2R)-2-(4-methoxyphenyl)-2-morpholin-4-ium-4-yl-ethyl]thiourea Formula: C20H32N3O2S+ MolecularWeight: 378.55198

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(CNC(=S)NC2CCCCC2)[NH+]3CCOCC3

Isomeric SMILES

COC1=CC=C(C=C1)[C@H](CNC(=S)NC2CCCCC2)[NH+]3CCOCC3

InChI

InChI=1S/C20H31N3O2S/c1-24-18-9-7-16(8-10-18)19(23-11-13-25-14-12-23)15-21-20(26)22-17-5-3-2-4-6-17/h7-10,17,19H,2-6,11-15H2,1H3,(H2,21,22,26)/p+1/t19-/m0/s1