1-(2-cyanoethyl)-3-[(4-fluorophenyl)methyl]thiourea

Systemtic Name: 1-(2-cyanoethyl)-3-[(4-fluorophenyl)methyl]thiourea Openeye Name: 1-(2-cyanoethyl)-3-[(4-fluorophenyl)methyl]thiourea CAS Name: 1-(2-cyanoethyl)-3-[(4-fluorophenyl)methyl]thiourea IUPAC Name: 1-(2-cyanoethyl)-3-[(4-fluorophenyl)methyl]thiourea Traditional Name: 1-(2-cyanoethyl)-3-(4-fluorobenzyl)thiourea Formula: C11H12FN3S MolecularWeight: 237.296483

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC(=S)NCCC#N)F

Isomeric SMILES

C1=CC(=CC=C1CNC(=S)NCCC#N)F

InChI

InChI=1S/C11H12FN3S/c12-10-4-2-9(3-5-10)8-15-11(16)14-7-1-6-13/h2-5H,1,7-8H2,(H2,14,15,16)