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

Systemtic Name: 1-[(2R)-2-(furan-2-yl)-2-pyrrolidin-1-ium-1-yl-ethyl]-3-phenyl-thiourea Openeye Name: 1-[(2R)-2-(2-furyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-3-phenyl-thiourea CAS Name: 1-[(2R)-2-(2-furanyl)-2-(1-pyrrolidin-1-iumyl)ethyl]-3-phenylthiourea IUPAC Name: 1-[(2R)-2-(furan-2-yl)-2-pyrrolidin-1-ium-1-ylethyl]-3-phenylthiourea Traditional Name: 1-[(2R)-2-(2-furyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-3-phenyl-thiourea Formula: C17H22N3OS+ MolecularWeight: 316.44108

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)C(CNC(=S)NC2=CC=CC=C2)C3=CC=CO3

Isomeric SMILES

C1CC[NH+](C1)[C@H](CNC(=S)NC2=CC=CC=C2)C3=CC=CO3

InChI

InChI=1S/C17H21N3OS/c22-17(19-14-7-2-1-3-8-14)18-13-15(16-9-6-12-21-16)20-10-4-5-11-20/h1-3,6-9,12,15H,4-5,10-11,13H2,(H2,18,19,22)/p+1/t15-/m1/s1