3-(2-bromanyl-4-fluoranyl-phenyl)-1-ethyl-1-[1-(phenylmethyl)pyrrolidin-3-yl]thiourea

Systemtic Name: 3-(2-bromanyl-4-fluoranyl-phenyl)-1-ethyl-1-[1-(phenylmethyl)pyrrolidin-3-yl]thiourea Openeye Name: 1-(1-benzylpyrrolidin-3-yl)-3-(2-bromo-4-fluoro-phenyl)-1-ethyl-thiourea CAS Name: 3-(2-bromo-4-fluorophenyl)-1-ethyl-1-[1-(phenylmethyl)-3-pyrrolidinyl]thiourea IUPAC Name: 1-(1-benzylpyrrolidin-3-yl)-3-(2-bromo-4-fluorophenyl)-1-ethylthiourea Traditional Name: 1-(1-benzylpyrrolidin-3-yl)-3-(2-bromo-4-fluoro-phenyl)-1-ethyl-thiourea Formula: C20H23BrFN3S MolecularWeight: 436.384123

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1CCN(C1)CC2=CC=CC=C2)C(=S)NC3=C(C=C(C=C3)F)Br

Isomeric SMILES

CCN(C1CCN(C1)CC2=CC=CC=C2)C(=S)NC3=C(C=C(C=C3)F)Br

InChI

InChI=1S/C20H23BrFN3S/c1-2-25(20(26)23-19-9-8-16(22)12-18(19)21)17-10-11-24(14-17)13-15-6-4-3-5-7-15/h3-9,12,17H,2,10-11,13-14H2,1H3,(H,23,26)