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

Systemtic Name: 1-cyclohexyl-3-[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]thiourea Openeye Name: 1-cyclohexyl-3-[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]thiourea CAS Name: 1-cyclohexyl-3-[(2R)-2-phenyl-2-(1-pyrrolidin-1-iumyl)ethyl]thiourea IUPAC Name: 1-cyclohexyl-3-[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-ylethyl]thiourea Traditional Name: 1-cyclohexyl-3-[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]thiourea Formula: C19H30N3S+ MolecularWeight: 332.5266

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=S)NCC(C2=CC=CC=C2)[NH+]3CCCC3

Isomeric SMILES

C1CCC(CC1)NC(=S)NC[C@@H](C2=CC=CC=C2)[NH+]3CCCC3

InChI

InChI=1S/C19H29N3S/c23-19(21-17-11-5-2-6-12-17)20-15-18(22-13-7-8-14-22)16-9-3-1-4-10-16/h1,3-4,9-10,17-18H,2,5-8,11-15H2,(H2,20,21,23)/p+1/t18-/m0/s1