2-[2-ethyl-4-(oxolan-3-yl)hexyl]imino-N-(3-fluorophenyl)-1,3-thiazolidine-3-carbothioamide

Systemtic Name: 2-[2-ethyl-4-(oxolan-3-yl)hexyl]imino-N-(3-fluorophenyl)-1,3-thiazolidine-3-carbothioamide Openeye Name: 2-(2-ethyl-4-tetrahydrofuran-3-yl-hexyl)imino-N-(3-fluorophenyl)thiazolidine-3-carbothioamide CAS Name: 2-[2-ethyl-4-(3-oxolanyl)hexyl]imino-N-(3-fluorophenyl)-3-thiazolidinecarbothioamide IUPAC Name: 2-[2-ethyl-4-(oxolan-3-yl)hexyl]imino-N-(3-fluorophenyl)-1,3-thiazolidine-3-carbothioamide Traditional Name: 2-(2-ethyl-4-tetrahydrofuran-3-yl-hexyl)imino-N-(3-fluorophenyl)thiazolidine-3-carbothioamide Formula: C22H32FN3OS2 MolecularWeight: 437.637383

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(CC)C1CCOC1)CN=C2N(CCS2)C(=S)NC3=CC(=CC=C3)F

Isomeric SMILES

CCC(CC(CC)C1CCOC1)CN=C2N(CCS2)C(=S)NC3=CC(=CC=C3)F

InChI

InChI=1S/C22H32FN3OS2/c1-3-16(12-17(4-2)18-8-10-27-15-18)14-24-22-26(9-11-29-22)21(28)25-20-7-5-6-19(23)13-20/h5-7,13,16-18H,3-4,8-12,14-15H2,1-2H3,(H,25,28)