2-(2,5-dimethylphenyl)sulfanyl-N-propyl-pyridine-3-carboxamide

Systemtic Name: 2-(2,5-dimethylphenyl)sulfanyl-N-propyl-pyridine-3-carboxamide Openeye Name: 2-(2,5-dimethylphenyl)sulfanyl-N-propyl-pyridine-3-carboxamide CAS Name: 2-[(2,5-dimethylphenyl)thio]-N-propyl-3-pyridinecarboxamide IUPAC Name: 2-(2,5-dimethylphenyl)sulfanyl-N-propylpyridine-3-carboxamide Traditional Name: 2-[(2,5-dimethylphenyl)thio]-N-propyl-nicotinamide Formula: C17H20N2OS MolecularWeight: 300.4185

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1=C(N=CC=C1)SC2=C(C=CC(=C2)C)C

Isomeric SMILES

CCCNC(=O)C1=C(N=CC=C1)SC2=C(C=CC(=C2)C)C

InChI

InChI=1S/C17H20N2OS/c1-4-9-18-16(20)14-6-5-10-19-17(14)21-15-11-12(2)7-8-13(15)3/h5-8,10-11H,4,9H2,1-3H3,(H,18,20)