1-[(4-fluorophenyl)methyl]-3-(3-pyrrolidin-1-ylsulfonylphenyl)thiourea

Systemtic Name: 1-[(4-fluorophenyl)methyl]-3-(3-pyrrolidin-1-ylsulfonylphenyl)thiourea Openeye Name: 1-[(4-fluorophenyl)methyl]-3-(3-pyrrolidin-1-ylsulfonylphenyl)thiourea CAS Name: 1-[(4-fluorophenyl)methyl]-3-[3-(1-pyrrolidinylsulfonyl)phenyl]thiourea IUPAC Name: 1-[(4-fluorophenyl)methyl]-3-(3-pyrrolidin-1-ylsulfonylphenyl)thiourea Traditional Name: 1-(4-fluorobenzyl)-3-(3-pyrrolidinosulfonylphenyl)thiourea Formula: C18H20FN3O2S2 MolecularWeight: 393.498703

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)NC(=S)NCC3=CC=C(C=C3)F

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)NC(=S)NCC3=CC=C(C=C3)F

InChI

InChI=1S/C18H20FN3O2S2/c19-15-8-6-14(7-9-15)13-20-18(25)21-16-4-3-5-17(12-16)26(23,24)22-10-1-2-11-22/h3-9,12H,1-2,10-11,13H2,(H2,20,21,25)