N-(cyclohexylmethyl)-2-(2,5-dimethoxyphenyl)sulfanyl-pyridine-3-carboxamide

Systemtic Name: N-(cyclohexylmethyl)-2-(2,5-dimethoxyphenyl)sulfanyl-pyridine-3-carboxamide Openeye Name: N-(cyclohexylmethyl)-2-(2,5-dimethoxyphenyl)sulfanyl-pyridine-3-carboxamide CAS Name: N-(cyclohexylmethyl)-2-[(2,5-dimethoxyphenyl)thio]-3-pyridinecarboxamide IUPAC Name: N-(cyclohexylmethyl)-2-(2,5-dimethoxyphenyl)sulfanylpyridine-3-carboxamide Traditional Name: N-(cyclohexylmethyl)-2-[(2,5-dimethoxyphenyl)thio]nicotinamide Formula: C21H26N2O3S MolecularWeight: 386.50774

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)SC2=C(C=CC=N2)C(=O)NCC3CCCCC3

Isomeric SMILES

COC1=CC(=C(C=C1)OC)SC2=C(C=CC=N2)C(=O)NCC3CCCCC3

InChI

InChI=1S/C21H26N2O3S/c1-25-16-10-11-18(26-2)19(13-16)27-21-17(9-6-12-22-21)20(24)23-14-15-7-4-3-5-8-15/h6,9-13,15H,3-5,7-8,14H2,1-2H3,(H,23,24)