3-(3,4-dichlorophenyl)-1-[(4-fluorophenyl)methyl]-1-(3-imidazol-1-ylpropyl)thiourea

Systemtic Name: 3-(3,4-dichlorophenyl)-1-[(4-fluorophenyl)methyl]-1-(3-imidazol-1-ylpropyl)thiourea Openeye Name: 3-(3,4-dichlorophenyl)-1-[(4-fluorophenyl)methyl]-1-(3-imidazol-1-ylpropyl)thiourea CAS Name: 3-(3,4-dichlorophenyl)-1-[(4-fluorophenyl)methyl]-1-[3-(1-imidazolyl)propyl]thiourea IUPAC Name: 3-(3,4-dichlorophenyl)-1-[(4-fluorophenyl)methyl]-1-(3-imidazol-1-ylpropyl)thiourea Traditional Name: 3-(3,4-dichlorophenyl)-1-(4-fluorobenzyl)-1-(3-imidazol-1-ylpropyl)thiourea Formula: C20H19Cl2FN4S MolecularWeight: 437.361063

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CN(CCCN2C=CN=C2)C(=S)NC3=CC(=C(C=C3)Cl)Cl)F

Isomeric SMILES

C1=CC(=CC=C1CN(CCCN2C=CN=C2)C(=S)NC3=CC(=C(C=C3)Cl)Cl)F

InChI

InChI=1S/C20H19Cl2FN4S/c21-18-7-6-17(12-19(18)22)25-20(28)27(10-1-9-26-11-8-24-14-26)13-15-2-4-16(23)5-3-15/h2-8,11-12,14H,1,9-10,13H2,(H,25,28)