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

Systemtic Name: N-(3-cyanophenyl)-2-[2-ethyl-4-(oxolan-3-yl)hexyl]-1,3-thiazolidine-3-carbothioamide Openeye Name: N-(3-cyanophenyl)-2-(2-ethyl-4-tetrahydrofuran-3-yl-hexyl)thiazolidine-3-carbothioamide CAS Name: N-(3-cyanophenyl)-2-[2-ethyl-4-(3-oxolanyl)hexyl]-3-thiazolidinecarbothioamide IUPAC Name: N-(3-cyanophenyl)-2-[2-ethyl-4-(oxolan-3-yl)hexyl]-1,3-thiazolidine-3-carbothioamide Traditional Name: N-(3-cyanophenyl)-2-(2-ethyl-4-tetrahydrofuran-3-yl-hexyl)thiazolidine-3-carbothioamide Formula: C23H33N3OS2 MolecularWeight: 431.65762

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC1N(CCS1)C(=S)NC2=CC=CC(=C2)C#N)CC(CC)C3CCOC3

Isomeric SMILES

CCC(CC1N(CCS1)C(=S)NC2=CC=CC(=C2)C#N)CC(CC)C3CCOC3

InChI

InChI=1S/C23H33N3OS2/c1-3-17(12-19(4-2)20-8-10-27-16-20)14-22-26(9-11-29-22)23(28)25-21-7-5-6-18(13-21)15-24/h5-7,13,17,19-20,22H,3-4,8-12,14,16H2,1-2H3,(H,25,28)