N-[2-(3,4-dimethylphenyl)sulfanylethyl]-3-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)propanamide

Systemtic Name: N-[2-(3,4-dimethylphenyl)sulfanylethyl]-3-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)propanamide Openeye Name: N-[2-(3,4-dimethylphenyl)sulfanylethyl]-3-[3-(4-pyridyl)-1,2,4-oxadiazol-5-yl]propanamide CAS Name: N-[2-[(3,4-dimethylphenyl)thio]ethyl]-3-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)propanamide IUPAC Name: N-[2-(3,4-dimethylphenyl)sulfanylethyl]-3-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)propanamide Traditional Name: N-[2-[(3,4-dimethylphenyl)thio]ethyl]-3-[3-(4-pyridyl)-1,2,4-oxadiazol-5-yl]propionamide Formula: C20H22N4O2S MolecularWeight: 382.47928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)SCCNC(=O)CCC2=NC(=NO2)C3=CC=NC=C3)C

Isomeric SMILES

CC1=C(C=C(C=C1)SCCNC(=O)CCC2=NC(=NO2)C3=CC=NC=C3)C

InChI

InChI=1S/C20H22N4O2S/c1-14-3-4-17(13-15(14)2)27-12-11-22-18(25)5-6-19-23-20(24-26-19)16-7-9-21-10-8-16/h3-4,7-10,13H,5-6,11-12H2,1-2H3,(H,22,25)