N-(5-chloranyl-2-methyl-phenyl)-2-(4-pyridin-3-ylhexyl)-1,3-thiazolidine-3-carbothioamide

Systemtic Name: N-(5-chloranyl-2-methyl-phenyl)-2-(4-pyridin-3-ylhexyl)-1,3-thiazolidine-3-carbothioamide Openeye Name: N-(5-chloro-2-methyl-phenyl)-2-[4-(3-pyridyl)hexyl]thiazolidine-3-carbothioamide CAS Name: N-(5-chloro-2-methylphenyl)-2-[4-(3-pyridinyl)hexyl]-3-thiazolidinecarbothioamide IUPAC Name: N-(5-chloro-2-methylphenyl)-2-(4-pyridin-3-ylhexyl)-1,3-thiazolidine-3-carbothioamide Traditional Name: N-(5-chloro-2-methyl-phenyl)-2-[4-(3-pyridyl)hexyl]thiazolidine-3-carbothioamide Formula: C22H28ClN3S2 MolecularWeight: 434.06082

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CCCC1N(CCS1)C(=S)NC2=C(C=CC(=C2)Cl)C)C3=CN=CC=C3

Isomeric SMILES

CCC(CCCC1N(CCS1)C(=S)NC2=C(C=CC(=C2)Cl)C)C3=CN=CC=C3

InChI

InChI=1S/C22H28ClN3S2/c1-3-17(18-7-5-11-24-15-18)6-4-8-21-26(12-13-28-21)22(27)25-20-14-19(23)10-9-16(20)2/h5,7,9-11,14-15,17,21H,3-4,6,8,12-13H2,1-2H3,(H,25,27)