1-(furan-2-ylmethyl)-3-[(2R)-2-(furan-2-yl)-2-piperidin-1-ium-1-yl-ethyl]thiourea

Systemtic Name: 1-(furan-2-ylmethyl)-3-[(2R)-2-(furan-2-yl)-2-piperidin-1-ium-1-yl-ethyl]thiourea Openeye Name: 1-(2-furylmethyl)-3-[(2R)-2-(2-furyl)-2-piperidin-1-ium-1-yl-ethyl]thiourea CAS Name: 1-(2-furanylmethyl)-3-[(2R)-2-(2-furanyl)-2-(1-piperidin-1-iumyl)ethyl]thiourea IUPAC Name: 1-(furan-2-ylmethyl)-3-[(2R)-2-(furan-2-yl)-2-piperidin-1-ium-1-ylethyl]thiourea Traditional Name: 1-(2-furfuryl)-3-[(2R)-2-(2-furyl)-2-piperidin-1-ium-1-yl-ethyl]thiourea Formula: C17H24N3O2S+ MolecularWeight: 334.45636

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)C(CNC(=S)NCC2=CC=CO2)C3=CC=CO3

Isomeric SMILES

C1CC[NH+](CC1)[C@H](CNC(=S)NCC2=CC=CO2)C3=CC=CO3

InChI

InChI=1S/C17H23N3O2S/c23-17(18-12-14-6-4-10-21-14)19-13-15(16-7-5-11-22-16)20-8-2-1-3-9-20/h4-7,10-11,15H,1-3,8-9,12-13H2,(H2,18,19,23)/p+1/t15-/m1/s1