1-(4-ethoxyphenyl)-3-[(2R)-2-(furan-2-yl)-2-pyrrolidin-1-ium-1-yl-ethyl]thiourea

Systemtic Name: 1-(4-ethoxyphenyl)-3-[(2R)-2-(furan-2-yl)-2-pyrrolidin-1-ium-1-yl-ethyl]thiourea Openeye Name: 1-(4-ethoxyphenyl)-3-[(2R)-2-(2-furyl)-2-pyrrolidin-1-ium-1-yl-ethyl]thiourea CAS Name: 1-(4-ethoxyphenyl)-3-[(2R)-2-(2-furanyl)-2-(1-pyrrolidin-1-iumyl)ethyl]thiourea IUPAC Name: 1-(4-ethoxyphenyl)-3-[(2R)-2-(furan-2-yl)-2-pyrrolidin-1-ium-1-ylethyl]thiourea Traditional Name: 1-[(2R)-2-(2-furyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-3-p-phenetyl-thiourea Formula: C19H26N3O2S+ MolecularWeight: 360.49364

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=S)NCC(C2=CC=CO2)[NH+]3CCCC3

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=S)NC[C@H](C2=CC=CO2)[NH+]3CCCC3

InChI

InChI=1S/C19H25N3O2S/c1-2-23-16-9-7-15(8-10-16)21-19(25)20-14-17(18-6-5-13-24-18)22-11-3-4-12-22/h5-10,13,17H,2-4,11-12,14H2,1H3,(H2,20,21,25)/p+1/t17-/m1/s1