3-cyclooctyl-1-[(1-ethylpyrrolidin-2-yl)methyl]-1-[(2-fluorophenyl)methyl]thiourea

Systemtic Name: 3-cyclooctyl-1-[(1-ethylpyrrolidin-2-yl)methyl]-1-[(2-fluorophenyl)methyl]thiourea Openeye Name: 3-cyclooctyl-1-[(1-ethylpyrrolidin-2-yl)methyl]-1-[(2-fluorophenyl)methyl]thiourea CAS Name: 3-cyclooctyl-1-[(1-ethyl-2-pyrrolidinyl)methyl]-1-[(2-fluorophenyl)methyl]thiourea IUPAC Name: 3-cyclooctyl-1-[(1-ethylpyrrolidin-2-yl)methyl]-1-[(2-fluorophenyl)methyl]thiourea Traditional Name: 3-cyclooctyl-1-[(1-ethylpyrrolidin-2-yl)methyl]-1-(2-fluorobenzyl)thiourea Formula: C23H36FN3S MolecularWeight: 405.615443

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCCC1CN(CC2=CC=CC=C2F)C(=S)NC3CCCCCCC3

Isomeric SMILES

CCN1CCCC1CN(CC2=CC=CC=C2F)C(=S)NC3CCCCCCC3

InChI

InChI=1S/C23H36FN3S/c1-2-26-16-10-14-21(26)18-27(17-19-11-8-9-15-22(19)24)23(28)25-20-12-6-4-3-5-7-13-20/h8-9,11,15,20-21H,2-7,10,12-14,16-18H2,1H3,(H,25,28)