1-[4-[2-(4-fluorophenyl)-2-oxidanylidene-ethyl]sulfanylphenyl]-3-phenyl-thiourea

Systemtic Name: 1-[4-[2-(4-fluorophenyl)-2-oxidanylidene-ethyl]sulfanylphenyl]-3-phenyl-thiourea Openeye Name: 1-[4-[2-(4-fluorophenyl)-2-oxo-ethyl]sulfanylphenyl]-3-phenyl-thiourea CAS Name: 1-[4-[[2-(4-fluorophenyl)-2-oxoethyl]thio]phenyl]-3-phenylthiourea IUPAC Name: 1-[4-[2-(4-fluorophenyl)-2-oxoethyl]sulfanylphenyl]-3-phenylthiourea Traditional Name: 1-[4-[[2-(4-fluorophenyl)-2-keto-ethyl]thio]phenyl]-3-phenyl-thiourea Formula: C21H17FN2OS2 MolecularWeight: 396.500883

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=S)NC2=CC=C(C=C2)SCC(=O)C3=CC=C(C=C3)F

Isomeric SMILES

C1=CC=C(C=C1)NC(=S)NC2=CC=C(C=C2)SCC(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H17FN2OS2/c22-16-8-6-15(7-9-16)20(25)14-27-19-12-10-18(11-13-19)24-21(26)23-17-4-2-1-3-5-17/h1-13H,14H2,(H2,23,24,26)