1-(2-cyanoethyl)-1-(4-fluorophenyl)-3-(4-phenoxyphenyl)thiourea

Systemtic Name: 1-(2-cyanoethyl)-1-(4-fluorophenyl)-3-(4-phenoxyphenyl)thiourea Openeye Name: 1-(2-cyanoethyl)-1-(4-fluorophenyl)-3-(4-phenoxyphenyl)thiourea CAS Name: 1-(2-cyanoethyl)-1-(4-fluorophenyl)-3-(4-phenoxyphenyl)thiourea IUPAC Name: 1-(2-cyanoethyl)-1-(4-fluorophenyl)-3-(4-phenoxyphenyl)thiourea Traditional Name: 1-(2-cyanoethyl)-1-(4-fluorophenyl)-3-(4-phenoxyphenyl)thiourea Formula: C22H18FN3OS MolecularWeight: 391.461223

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=S)N(CCC#N)C3=CC=C(C=C3)F

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=S)N(CCC#N)C3=CC=C(C=C3)F

InChI

InChI=1S/C22H18FN3OS/c23-17-7-11-19(12-8-17)26(16-4-15-24)22(28)25-18-9-13-21(14-10-18)27-20-5-2-1-3-6-20/h1-3,5-14H,4,16H2,(H,25,28)