N-(2-ethylphenyl)-4-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]piperazine-1-carbothioamide

Systemtic Name: N-(2-ethylphenyl)-4-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]piperazine-1-carbothioamide Openeye Name: N-(2-ethylphenyl)-4-[4-(4-fluorophenyl)thiazol-2-yl]piperazine-1-carbothioamide CAS Name: N-(2-ethylphenyl)-4-[4-(4-fluorophenyl)-2-thiazolyl]-1-piperazinecarbothioamide IUPAC Name: N-(2-ethylphenyl)-4-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]piperazine-1-carbothioamide Traditional Name: N-(2-ethylphenyl)-4-[4-(4-fluorophenyl)thiazol-2-yl]piperazine-1-carbothioamide Formula: C22H23FN4S2 MolecularWeight: 426.573223

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=S)N2CCN(CC2)C3=NC(=CS3)C4=CC=C(C=C4)F

Isomeric SMILES

CCC1=CC=CC=C1NC(=S)N2CCN(CC2)C3=NC(=CS3)C4=CC=C(C=C4)F

InChI

InChI=1S/C22H23FN4S2/c1-2-16-5-3-4-6-19(16)24-21(28)26-11-13-27(14-12-26)22-25-20(15-29-22)17-7-9-18(23)10-8-17/h3-10,15H,2,11-14H2,1H3,(H,24,28)