1-[(4-fluorophenyl)methyl]-3-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]thiourea

Systemtic Name: 1-[(4-fluorophenyl)methyl]-3-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]thiourea Openeye Name: 1-[(4-fluorophenyl)methyl]-3-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]thiourea CAS Name: 1-[(4-fluorophenyl)methyl]-3-[[4-(1-pyrrolidin-1-iumylmethyl)phenyl]methyl]thiourea IUPAC Name: 1-[(4-fluorophenyl)methyl]-3-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]thiourea Traditional Name: 1-(4-fluorobenzyl)-3-[4-(pyrrolidin-1-ium-1-ylmethyl)benzyl]thiourea Formula: C20H25FN3S+ MolecularWeight: 358.496003

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CC2=CC=C(C=C2)CNC(=S)NCC3=CC=C(C=C3)F

Isomeric SMILES

C1CC[NH+](C1)CC2=CC=C(C=C2)CNC(=S)NCC3=CC=C(C=C3)F

InChI

InChI=1S/C20H24FN3S/c21-19-9-7-17(8-10-19)14-23-20(25)22-13-16-3-5-18(6-4-16)15-24-11-1-2-12-24/h3-10H,1-2,11-15H2,(H2,22,23,25)/p+1