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

Systemtic Name: 1-[(2R)-2-(furan-2-yl)-2-piperidin-1-ium-1-yl-ethyl]-3-[(4-methoxyphenyl)methyl]thiourea Openeye Name: 1-[(2R)-2-(2-furyl)-2-piperidin-1-ium-1-yl-ethyl]-3-[(4-methoxyphenyl)methyl]thiourea CAS Name: 1-[(2R)-2-(2-furanyl)-2-(1-piperidin-1-iumyl)ethyl]-3-[(4-methoxyphenyl)methyl]thiourea IUPAC Name: 1-[(2R)-2-(furan-2-yl)-2-piperidin-1-ium-1-ylethyl]-3-[(4-methoxyphenyl)methyl]thiourea Traditional Name: 1-[(2R)-2-(2-furyl)-2-piperidin-1-ium-1-yl-ethyl]-3-p-anisyl-thiourea Formula: C20H28N3O2S+ MolecularWeight: 374.52022

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC(=S)NCC(C2=CC=CO2)[NH+]3CCCCC3

Isomeric SMILES

COC1=CC=C(C=C1)CNC(=S)NC[C@H](C2=CC=CO2)[NH+]3CCCCC3

InChI

InChI=1S/C20H27N3O2S/c1-24-17-9-7-16(8-10-17)14-21-20(26)22-15-18(19-6-5-13-25-19)23-11-3-2-4-12-23/h5-10,13,18H,2-4,11-12,14-15H2,1H3,(H2,21,22,26)/p+1/t18-/m1/s1