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

Systemtic Name: 1-(2-cyanoethyl)-3-(4-fluorophenyl)-1-(2-methoxyphenyl)thiourea Openeye Name: 1-(2-cyanoethyl)-3-(4-fluorophenyl)-1-(2-methoxyphenyl)thiourea CAS Name: 1-(2-cyanoethyl)-3-(4-fluorophenyl)-1-(2-methoxyphenyl)thiourea IUPAC Name: 1-(2-cyanoethyl)-3-(4-fluorophenyl)-1-(2-methoxyphenyl)thiourea Traditional Name: 1-(2-cyanoethyl)-3-(4-fluorophenyl)-1-(2-methoxyphenyl)thiourea Formula: C17H16FN3OS MolecularWeight: 329.391843

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N(CCC#N)C(=S)NC2=CC=C(C=C2)F

Isomeric SMILES

COC1=CC=CC=C1N(CCC#N)C(=S)NC2=CC=C(C=C2)F

InChI

InChI=1S/C17H16FN3OS/c1-22-16-6-3-2-5-15(16)21(12-4-11-19)17(23)20-14-9-7-13(18)8-10-14/h2-3,5-10H,4,12H2,1H3,(H,20,23)