N-(2-methylsulfanylphenyl)-3-[4-(2-morpholin-4-ylethanoyl)piperazin-1-yl]propanamide

Systemtic Name: N-(2-methylsulfanylphenyl)-3-[4-(2-morpholin-4-ylethanoyl)piperazin-1-yl]propanamide Openeye Name: N-(2-methylsulfanylphenyl)-3-[4-(2-morpholinoacetyl)piperazin-1-yl]propanamide CAS Name: N-[2-(methylthio)phenyl]-3-[4-[2-(4-morpholinyl)-1-oxoethyl]-1-piperazinyl]propanamide IUPAC Name: N-(2-methylsulfanylphenyl)-3-[4-(2-morpholin-4-ylacetyl)piperazin-1-yl]propanamide Traditional Name: N-[2-(methylthio)phenyl]-3-[4-(2-morpholinoacetyl)piperazino]propionamide Formula: C20H30N4O3S MolecularWeight: 406.5422

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1NC(=O)CCN2CCN(CC2)C(=O)CN3CCOCC3

Isomeric SMILES

CSC1=CC=CC=C1NC(=O)CCN2CCN(CC2)C(=O)CN3CCOCC3

InChI

InChI=1S/C20H30N4O3S/c1-28-18-5-3-2-4-17(18)21-19(25)6-7-22-8-10-24(11-9-22)20(26)16-23-12-14-27-15-13-23/h2-5H,6-16H2,1H3,(H,21,25)