1-[(2R)-2-(4-methoxyphenyl)-2-piperidin-1-ium-1-yl-ethyl]-3-[[(2R)-oxolan-2-yl]methyl]thiourea

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(CNC(=S)NCC2CCCO2)[NH+]3CCCCC3

Isomeric SMILES

COC1=CC=C(C=C1)[C@H](CNC(=S)NC[C@H]2CCCO2)[NH+]3CCCCC3

InChI

InChI=1S/C20H31N3O2S/c1-24-17-9-7-16(8-10-17)19(23-11-3-2-4-12-23)15-22-20(26)21-14-18-6-5-13-25-18/h7-10,18-19H,2-6,11-15H2,1H3,(H2,21,22,26)/p+1/t18-,19+/m1/s1