2-methyl-3-(3-pyridin-4-ylpropoxy)propanethioamide

Systemtic Name: 2-methyl-3-(3-pyridin-4-ylpropoxy)propanethioamide Openeye Name: 2-methyl-3-[3-(4-pyridyl)propoxy]propanethioamide CAS Name: 2-methyl-3-(3-pyridin-4-ylpropoxy)propanethioamide IUPAC Name: 2-methyl-3-(3-pyridin-4-ylpropoxy)propanethioamide Traditional Name: 2-methyl-3-[3-(4-pyridyl)propoxy]thiopropionamide Formula: C12H18N2OS MolecularWeight: 238.34912

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Descriptors Computed from Structure

Canonical SMILES:

CC(COCCCC1=CC=NC=C1)C(=S)N

Isomeric SMILES

CC(COCCCC1=CC=NC=C1)C(=S)N

InChI

InChI=1S/C12H18N2OS/c1-10(12(13)16)9-15-8-2-3-11-4-6-14-7-5-11/h4-7,10H,2-3,8-9H2,1H3,(H2,13,16)