1-[(2-chlorophenyl)methyl]-3-(4-fluorophenyl)-1-(3-imidazol-1-ylpropyl)thiourea

Systemtic Name: 1-[(2-chlorophenyl)methyl]-3-(4-fluorophenyl)-1-(3-imidazol-1-ylpropyl)thiourea Openeye Name: 1-[(2-chlorophenyl)methyl]-3-(4-fluorophenyl)-1-(3-imidazol-1-ylpropyl)thiourea CAS Name: 1-[(2-chlorophenyl)methyl]-3-(4-fluorophenyl)-1-[3-(1-imidazolyl)propyl]thiourea IUPAC Name: 1-[(2-chlorophenyl)methyl]-3-(4-fluorophenyl)-1-(3-imidazol-1-ylpropyl)thiourea Traditional Name: 1-(2-chlorobenzyl)-3-(4-fluorophenyl)-1-(3-imidazol-1-ylpropyl)thiourea Formula: C20H20ClFN4S MolecularWeight: 402.916003

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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