1-[(4-fluorophenyl)methyl]-3-[(2R)-2-(4-methoxyphenyl)-2-piperidin-1-yl-ethyl]thiourea

Systemtic Name: 1-[(4-fluorophenyl)methyl]-3-[(2R)-2-(4-methoxyphenyl)-2-piperidin-1-yl-ethyl]thiourea Openeye Name: 1-[(4-fluorophenyl)methyl]-3-[(2R)-2-(4-methoxyphenyl)-2-(1-piperidyl)ethyl]thiourea CAS Name: 1-[(4-fluorophenyl)methyl]-3-[(2R)-2-(4-methoxyphenyl)-2-(1-piperidinyl)ethyl]thiourea IUPAC Name: 1-[(4-fluorophenyl)methyl]-3-[(2R)-2-(4-methoxyphenyl)-2-piperidin-1-ylethyl]thiourea Traditional Name: 1-(4-fluorobenzyl)-3-[(2R)-2-(4-methoxyphenyl)-2-piperidino-ethyl]thiourea Formula: C22H28FN3OS MolecularWeight: 401.540623

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(CNC(=S)NCC2=CC=C(C=C2)F)N3CCCCC3

Isomeric SMILES

COC1=CC=C(C=C1)[C@H](CNC(=S)NCC2=CC=C(C=C2)F)N3CCCCC3

InChI

InChI=1S/C22H28FN3OS/c1-27-20-11-7-18(8-12-20)21(26-13-3-2-4-14-26)16-25-22(28)24-15-17-5-9-19(23)10-6-17/h5-12,21H,2-4,13-16H2,1H3,(H2,24,25,28)/t21-/m0/s1