3-(1,3-benzodioxol-5-ylmethyl)-2-(4-fluorophenyl)imino-4-oxidanylidene-N-(4-propoxyphenyl)-1,3-thiazinane-6-carboxamide

Systemtic Name: 3-(1,3-benzodioxol-5-ylmethyl)-2-(4-fluorophenyl)imino-4-oxidanylidene-N-(4-propoxyphenyl)-1,3-thiazinane-6-carboxamide Openeye Name: 3-(1,3-benzodioxol-5-ylmethyl)-2-(4-fluorophenyl)imino-4-oxo-N-(4-propoxyphenyl)-1,3-thiazinane-6-carboxamide CAS Name: 3-(1,3-benzodioxol-5-ylmethyl)-2-(4-fluorophenyl)imino-4-oxo-N-(4-propoxyphenyl)-1,3-thiazinane-6-carboxamide IUPAC Name: 3-(1,3-benzodioxol-5-ylmethyl)-2-(4-fluorophenyl)imino-4-oxo-N-(4-propoxyphenyl)-1,3-thiazinane-6-carboxamide Traditional Name: 2-(4-fluorophenyl)imino-4-keto-3-piperonyl-N-(4-propoxyphenyl)-1,3-thiazinane-6-carboxamide Formula: C28H26FN3O5S MolecularWeight: 535.586543

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)NC(=O)C2CC(=O)N(C(=NC3=CC=C(C=C3)F)S2)CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CCCOC1=CC=C(C=C1)NC(=O)C2CC(=O)N(C(=NC3=CC=C(C=C3)F)S2)CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C28H26FN3O5S/c1-2-13-35-22-10-8-20(9-11-22)30-27(34)25-15-26(33)32(16-18-3-12-23-24(14-18)37-17-36-23)28(38-25)31-21-6-4-19(29)5-7-21/h3-12,14,25H,2,13,15-17H2,1H3,(H,30,34)