4-(3-cyano-6-ethoxy-naphthalen-2-yl)-N-(2-fluorophenyl)piperazine-1-carbothioamide

Systemtic Name: 4-(3-cyano-6-ethoxy-naphthalen-2-yl)-N-(2-fluorophenyl)piperazine-1-carbothioamide Openeye Name: 4-(3-cyano-6-ethoxy-2-naphthyl)-N-(2-fluorophenyl)piperazine-1-carbothioamide CAS Name: 4-(3-cyano-6-ethoxy-2-naphthalenyl)-N-(2-fluorophenyl)-1-piperazinecarbothioamide IUPAC Name: 4-(3-cyano-6-ethoxynaphthalen-2-yl)-N-(2-fluorophenyl)piperazine-1-carbothioamide Traditional Name: 4-(3-cyano-6-ethoxy-2-naphthyl)-N-(2-fluorophenyl)piperazine-1-carbothioamide Formula: C24H23FN4OS MolecularWeight: 434.529023

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)C=C(C(=C2)C#N)N3CCN(CC3)C(=S)NC4=CC=CC=C4F

Isomeric SMILES

CCOC1=CC2=C(C=C1)C=C(C(=C2)C#N)N3CCN(CC3)C(=S)NC4=CC=CC=C4F

InChI

InChI=1S/C24H23FN4OS/c1-2-30-20-8-7-17-15-23(19(16-26)13-18(17)14-20)28-9-11-29(12-10-28)24(31)27-22-6-4-3-5-21(22)25/h3-8,13-15H,2,9-12H2,1H3,(H,27,31)