1-[2-(3-chlorophenyl)ethyl]-3-(4-fluoranyl-1,3-benzothiazol-2-yl)thiourea

Systemtic Name: 1-[2-(3-chlorophenyl)ethyl]-3-(4-fluoranyl-1,3-benzothiazol-2-yl)thiourea Openeye Name: 1-[2-(3-chlorophenyl)ethyl]-3-(4-fluoro-1,3-benzothiazol-2-yl)thiourea CAS Name: 1-[2-(3-chlorophenyl)ethyl]-3-(4-fluoro-1,3-benzothiazol-2-yl)thiourea IUPAC Name: 1-[2-(3-chlorophenyl)ethyl]-3-(4-fluoro-1,3-benzothiazol-2-yl)thiourea Traditional Name: 1-[2-(3-chlorophenyl)ethyl]-3-(4-fluoro-1,3-benzothiazol-2-yl)thiourea Formula: C16H13ClFN3S2 MolecularWeight: 365.875923

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)CCNC(=S)NC2=NC3=C(C=CC=C3S2)F

Isomeric SMILES

C1=CC(=CC(=C1)Cl)CCNC(=S)NC2=NC3=C(C=CC=C3S2)F

InChI

InChI=1S/C16H13ClFN3S2/c17-11-4-1-3-10(9-11)7-8-19-15(22)21-16-20-14-12(18)5-2-6-13(14)23-16/h1-6,9H,7-8H2,(H2,19,20,21,22)