(E)-5-(1,3-benzodioxol-5-yl)-1-thiomorpholin-4-yl-pent-2-en-1-one

Systemtic Name: (E)-5-(1,3-benzodioxol-5-yl)-1-thiomorpholin-4-yl-pent-2-en-1-one Openeye Name: (E)-5-(1,3-benzodioxol-5-yl)-1-thiomorpholino-pent-2-en-1-one CAS Name: (E)-5-(1,3-benzodioxol-5-yl)-1-thiomorpholin-4-yl-2-penten-1-one IUPAC Name: (E)-5-(1,3-benzodioxol-5-yl)-1-thiomorpholin-4-ylpent-2-en-1-one Traditional Name: (E)-5-(1,3-benzodioxol-5-yl)-1-thiomorpholino-pent-2-en-1-one Formula: C16H19NO3S MolecularWeight: 305.39196

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Descriptors Computed from Structure

Canonical SMILES:

C1CSCCN1C(=O)C=CCCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

C1CSCCN1C(=O)/C=C/CCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C16H19NO3S/c18-16(17-7-9-21-10-8-17)4-2-1-3-13-5-6-14-15(11-13)20-12-19-14/h2,4-6,11H,1,3,7-10,12H2/b4-2+