3-(4-bromophenyl)-1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-1-(pyridin-3-ylmethyl)thiourea

Systemtic Name: 3-(4-bromophenyl)-1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-1-(pyridin-3-ylmethyl)thiourea Openeye Name: 3-(4-bromophenyl)-1-[(2-chloro-6-fluoro-phenyl)methyl]-1-(3-pyridylmethyl)thiourea CAS Name: 3-(4-bromophenyl)-1-[(2-chloro-6-fluorophenyl)methyl]-1-(3-pyridinylmethyl)thiourea IUPAC Name: 3-(4-bromophenyl)-1-[(2-chloro-6-fluorophenyl)methyl]-1-(pyridin-3-ylmethyl)thiourea Traditional Name: 3-(4-bromophenyl)-1-(2-chloro-6-fluoro-benzyl)-1-(3-pyridylmethyl)thiourea Formula: C20H16BrClFN3S MolecularWeight: 464.781543

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)Cl)CN(CC2=CN=CC=C2)C(=S)NC3=CC=C(C=C3)Br)F

Isomeric SMILES

C1=CC(=C(C(=C1)Cl)CN(CC2=CN=CC=C2)C(=S)NC3=CC=C(C=C3)Br)F

InChI

InChI=1S/C20H16BrClFN3S/c21-15-6-8-16(9-7-15)25-20(27)26(12-14-3-2-10-24-11-14)13-17-18(22)4-1-5-19(17)23/h1-11H,12-13H2,(H,25,27)