1-[(1R,5S)-8-(furan-2-ylmethyl)-8-azoniabicyclo[3.2.1]octan-3-yl]-3-phenyl-thiourea

Systemtic Name: 1-[(1R,5S)-8-(furan-2-ylmethyl)-8-azoniabicyclo[3.2.1]octan-3-yl]-3-phenyl-thiourea Openeye Name: 1-[(1R,5S)-8-(2-furylmethyl)-8-azoniabicyclo[3.2.1]octan-3-yl]-3-phenyl-thiourea CAS Name: 1-[(1R,5S)-8-(2-furanylmethyl)-8-azoniabicyclo[3.2.1]octan-3-yl]-3-phenylthiourea IUPAC Name: 1-[(1R,5S)-8-(furan-2-ylmethyl)-8-azoniabicyclo[3.2.1]octan-3-yl]-3-phenylthiourea Traditional Name: 1-[(1R,5S)-8-(2-furfuryl)-8-azoniabicyclo[3.2.1]octan-3-yl]-3-phenyl-thiourea Formula: C19H24N3OS+ MolecularWeight: 342.47836

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2CC(CC1[NH+]2CC3=CC=CO3)NC(=S)NC4=CC=CC=C4

Isomeric SMILES

C1C[C@H]2CC(C[C@@H]1[NH+]2CC3=CC=CO3)NC(=S)NC4=CC=CC=C4

InChI

InChI=1S/C19H23N3OS/c24-19(20-14-5-2-1-3-6-14)21-15-11-16-8-9-17(12-15)22(16)13-18-7-4-10-23-18/h1-7,10,15-17H,8-9,11-13H2,(H2,20,21,24)/p+1/t15?,16-,17+