5,6-bis(4-chlorophenyl)-2-(methoxymethyl)-N-(2-oxidanylcyclohexyl)pyridine-3-carbothioamide

Systemtic Name: 5,6-bis(4-chlorophenyl)-2-(methoxymethyl)-N-(2-oxidanylcyclohexyl)pyridine-3-carbothioamide Openeye Name: 5,6-bis(4-chlorophenyl)-N-(2-hydroxycyclohexyl)-2-(methoxymethyl)pyridine-3-carbothioamide CAS Name: 5,6-bis(4-chlorophenyl)-N-(2-hydroxycyclohexyl)-2-(methoxymethyl)-3-pyridinecarbothioamide IUPAC Name: 5,6-bis(4-chlorophenyl)-N-(2-hydroxycyclohexyl)-2-(methoxymethyl)pyridine-3-carbothioamide Traditional Name: 5,6-bis(4-chlorophenyl)-N-(2-hydroxycyclohexyl)-2-(methoxymethyl)thionicotinamide Formula: C26H26Cl2N2O2S MolecularWeight: 501.46784

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Descriptors Computed from Structure

Canonical SMILES:

COCC1=C(C=C(C(=N1)C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)Cl)C(=S)NC4CCCCC4O

Isomeric SMILES

COCC1=C(C=C(C(=N1)C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)Cl)C(=S)NC4CCCCC4O

InChI

InChI=1S/C26H26Cl2N2O2S/c1-32-15-23-21(26(33)30-22-4-2-3-5-24(22)31)14-20(16-6-10-18(27)11-7-16)25(29-23)17-8-12-19(28)13-9-17/h6-14,22,24,31H,2-5,15H2,1H3,(H,30,33)