1-(2-cyanoethyl)-3-(4-fluorophenyl)-1-(pyridin-4-ylmethyl)thiourea

Systemtic Name: 1-(2-cyanoethyl)-3-(4-fluorophenyl)-1-(pyridin-4-ylmethyl)thiourea Openeye Name: 1-(2-cyanoethyl)-3-(4-fluorophenyl)-1-(4-pyridylmethyl)thiourea CAS Name: 1-(2-cyanoethyl)-3-(4-fluorophenyl)-1-(pyridin-4-ylmethyl)thiourea IUPAC Name: 1-(2-cyanoethyl)-3-(4-fluorophenyl)-1-(pyridin-4-ylmethyl)thiourea Traditional Name: 1-(2-cyanoethyl)-3-(4-fluorophenyl)-1-(4-pyridylmethyl)thiourea Formula: C16H15FN4S MolecularWeight: 314.380503

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=S)N(CCC#N)CC2=CC=NC=C2)F

Isomeric SMILES

C1=CC(=CC=C1NC(=S)N(CCC#N)CC2=CC=NC=C2)F

InChI

InChI=1S/C16H15FN4S/c17-14-2-4-15(5-3-14)20-16(22)21(11-1-8-18)12-13-6-9-19-10-7-13/h2-7,9-10H,1,11-12H2,(H,20,22)