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

Systemtic Name: 3-(2-chlorophenyl)-1-[(2-fluorophenyl)methyl]-1-(3-imidazol-1-ylpropyl)thiourea Openeye Name: 3-(2-chlorophenyl)-1-[(2-fluorophenyl)methyl]-1-(3-imidazol-1-ylpropyl)thiourea CAS Name: 3-(2-chlorophenyl)-1-[(2-fluorophenyl)methyl]-1-[3-(1-imidazolyl)propyl]thiourea IUPAC Name: 3-(2-chlorophenyl)-1-[(2-fluorophenyl)methyl]-1-(3-imidazol-1-ylpropyl)thiourea Traditional Name: 3-(2-chlorophenyl)-1-(2-fluorobenzyl)-1-(3-imidazol-1-ylpropyl)thiourea Formula: C20H20ClFN4S MolecularWeight: 402.916003

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CN(CCCN2C=CN=C2)C(=S)NC3=CC=CC=C3Cl)F

Isomeric SMILES

C1=CC=C(C(=C1)CN(CCCN2C=CN=C2)C(=S)NC3=CC=CC=C3Cl)F

InChI

InChI=1S/C20H20ClFN4S/c21-17-7-2-4-9-19(17)24-20(27)26(12-5-11-25-13-10-23-15-25)14-16-6-1-3-8-18(16)22/h1-4,6-10,13,15H,5,11-12,14H2,(H,24,27)