N-(2-methylsulfanylphenyl)-3-[4-(oxolan-2-ylcarbonyl)piperazin-1-yl]propanamide

Systemtic Name: N-(2-methylsulfanylphenyl)-3-[4-(oxolan-2-ylcarbonyl)piperazin-1-yl]propanamide Openeye Name: N-(2-methylsulfanylphenyl)-3-[4-(tetrahydrofuran-2-carbonyl)piperazin-1-yl]propanamide CAS Name: N-[2-(methylthio)phenyl]-3-[4-[oxo(2-oxolanyl)methyl]-1-piperazinyl]propanamide IUPAC Name: N-(2-methylsulfanylphenyl)-3-[4-(oxolane-2-carbonyl)piperazin-1-yl]propanamide Traditional Name: N-[2-(methylthio)phenyl]-3-[4-(tetrahydrofuran-2-carbonyl)piperazino]propionamide Formula: C19H27N3O3S MolecularWeight: 377.50098

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1NC(=O)CCN2CCN(CC2)C(=O)C3CCCO3

Isomeric SMILES

CSC1=CC=CC=C1NC(=O)CCN2CCN(CC2)C(=O)C3CCCO3

InChI

InChI=1S/C19H27N3O3S/c1-26-17-7-3-2-5-15(17)20-18(23)8-9-21-10-12-22(13-11-21)19(24)16-6-4-14-25-16/h2-3,5,7,16H,4,6,8-14H2,1H3,(H,20,23)