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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=S)N(CCC#N)C2=CC=C(C=C2)F

Isomeric SMILES

COC1=CC=CC(=C1)NC(=S)N(CCC#N)C2=CC=C(C=C2)F

InChI

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