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

Systemtic Name: 3-(2-chlorophenyl)-1-[(3-fluorophenyl)methyl]-1-(3-imidazol-1-ylpropyl)thiourea Openeye Name: 3-(2-chlorophenyl)-1-[(3-fluorophenyl)methyl]-1-(3-imidazol-1-ylpropyl)thiourea CAS Name: 3-(2-chlorophenyl)-1-[(3-fluorophenyl)methyl]-1-[3-(1-imidazolyl)propyl]thiourea IUPAC Name: 3-(2-chlorophenyl)-1-[(3-fluorophenyl)methyl]-1-(3-imidazol-1-ylpropyl)thiourea Traditional Name: 3-(2-chlorophenyl)-1-(3-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)NC(=S)N(CCCN2C=CN=C2)CC3=CC(=CC=C3)F)Cl

Isomeric SMILES

C1=CC=C(C(=C1)NC(=S)N(CCCN2C=CN=C2)CC3=CC(=CC=C3)F)Cl

InChI

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