2-(3,4-dimethylphenyl)sulfanyl-N-(3-propan-2-yloxypropyl)pyridine-3-carboxamide

Systemtic Name: 2-(3,4-dimethylphenyl)sulfanyl-N-(3-propan-2-yloxypropyl)pyridine-3-carboxamide Openeye Name: 2-(3,4-dimethylphenyl)sulfanyl-N-(3-isopropoxypropyl)pyridine-3-carboxamide CAS Name: 2-[(3,4-dimethylphenyl)thio]-N-(3-propan-2-yloxypropyl)-3-pyridinecarboxamide IUPAC Name: 2-(3,4-dimethylphenyl)sulfanyl-N-(3-propan-2-yloxypropyl)pyridine-3-carboxamide Traditional Name: 2-[(3,4-dimethylphenyl)thio]-N-(3-isopropoxypropyl)nicotinamide Formula: C20H26N2O2S MolecularWeight: 358.49764

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)SC2=C(C=CC=N2)C(=O)NCCCOC(C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)SC2=C(C=CC=N2)C(=O)NCCCOC(C)C)C

InChI

InChI=1S/C20H26N2O2S/c1-14(2)24-12-6-11-21-19(23)18-7-5-10-22-20(18)25-17-9-8-15(3)16(4)13-17/h5,7-10,13-14H,6,11-12H2,1-4H3,(H,21,23)