(2E,4E)-7-(1,3-benzodioxol-5-yl)-1-thiomorpholin-4-yl-hepta-2,4-dien-1-one

Systemtic Name: (2E,4E)-7-(1,3-benzodioxol-5-yl)-1-thiomorpholin-4-yl-hepta-2,4-dien-1-one Openeye Name: (2E,4E)-7-(1,3-benzodioxol-5-yl)-1-thiomorpholino-hepta-2,4-dien-1-one CAS Name: (2E,4E)-7-(1,3-benzodioxol-5-yl)-1-thiomorpholin-4-yl-1-hepta-2,4-dienone IUPAC Name: (2E,4E)-7-(1,3-benzodioxol-5-yl)-1-thiomorpholin-4-ylhepta-2,4-dien-1-one Traditional Name: (2E,4E)-7-(1,3-benzodioxol-5-yl)-1-thiomorpholino-hepta-2,4-dien-1-one Formula: C18H21NO3S MolecularWeight: 331.42924

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21NO3S/c20-18(19-9-11-23-12-10-19)6-4-2-1-3-5-15-7-8-16-17(13-15)22-14-21-16/h1-2,4,6-8,13H,3,5,9-12,14H2/b2-1+,6-4+