3-(2-fluorophenyl)-1-(3-imidazol-1-ylpropyl)-1-[(2-methoxyphenyl)methyl]thiourea

Systemtic Name: 3-(2-fluorophenyl)-1-(3-imidazol-1-ylpropyl)-1-[(2-methoxyphenyl)methyl]thiourea Openeye Name: 3-(2-fluorophenyl)-1-(3-imidazol-1-ylpropyl)-1-[(2-methoxyphenyl)methyl]thiourea CAS Name: 3-(2-fluorophenyl)-1-[3-(1-imidazolyl)propyl]-1-[(2-methoxyphenyl)methyl]thiourea IUPAC Name: 3-(2-fluorophenyl)-1-(3-imidazol-1-ylpropyl)-1-[(2-methoxyphenyl)methyl]thiourea Traditional Name: 3-(2-fluorophenyl)-1-(3-imidazol-1-ylpropyl)-1-o-anisyl-thiourea Formula: C21H23FN4OS MolecularWeight: 398.496923

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CN(CCCN2C=CN=C2)C(=S)NC3=CC=CC=C3F

Isomeric SMILES

COC1=CC=CC=C1CN(CCCN2C=CN=C2)C(=S)NC3=CC=CC=C3F

InChI

InChI=1S/C21H23FN4OS/c1-27-20-10-5-2-7-17(20)15-26(13-6-12-25-14-11-23-16-25)21(28)24-19-9-4-3-8-18(19)22/h2-5,7-11,14,16H,6,12-13,15H2,1H3,(H,24,28)