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

Systemtic Name: 1-[(2R)-2-(furan-2-yl)-2-pyrrolidin-1-ium-1-yl-ethyl]-3-(2-methylphenyl)thiourea Openeye Name: 1-[(2R)-2-(2-furyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-3-(o-tolyl)thiourea CAS Name: 1-[(2R)-2-(2-furanyl)-2-(1-pyrrolidin-1-iumyl)ethyl]-3-(2-methylphenyl)thiourea IUPAC Name: 1-[(2R)-2-(furan-2-yl)-2-pyrrolidin-1-ium-1-ylethyl]-3-(2-methylphenyl)thiourea Traditional Name: 1-[(2R)-2-(2-furyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-3-(o-tolyl)thiourea Formula: C18H24N3OS+ MolecularWeight: 330.46766

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=S)NCC(C2=CC=CO2)[NH+]3CCCC3

Isomeric SMILES

CC1=CC=CC=C1NC(=S)NC[C@H](C2=CC=CO2)[NH+]3CCCC3

InChI

InChI=1S/C18H23N3OS/c1-14-7-2-3-8-15(14)20-18(23)19-13-16(17-9-6-12-22-17)21-10-4-5-11-21/h2-3,6-9,12,16H,4-5,10-11,13H2,1H3,(H2,19,20,23)/p+1/t16-/m1/s1