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

Systemtic Name: 3-(1,3-benzodioxol-5-ylmethyl)-N-(3-bromophenyl)-2-(4-fluorophenyl)imino-4-oxidanylidene-1,3-thiazinane-6-carboxamide Openeye Name: 3-(1,3-benzodioxol-5-ylmethyl)-N-(3-bromophenyl)-2-(4-fluorophenyl)imino-4-oxo-1,3-thiazinane-6-carboxamide CAS Name: 3-(1,3-benzodioxol-5-ylmethyl)-N-(3-bromophenyl)-2-(4-fluorophenyl)imino-4-oxo-1,3-thiazinane-6-carboxamide IUPAC Name: 3-(1,3-benzodioxol-5-ylmethyl)-N-(3-bromophenyl)-2-(4-fluorophenyl)imino-4-oxo-1,3-thiazinane-6-carboxamide Traditional Name: N-(3-bromophenyl)-2-(4-fluorophenyl)imino-4-keto-3-piperonyl-1,3-thiazinane-6-carboxamide Formula: C25H19BrFN3O4S MolecularWeight: 556.403463

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Descriptors Computed from Structure

Canonical SMILES:

C1C(SC(=NC2=CC=C(C=C2)F)N(C1=O)CC3=CC4=C(C=C3)OCO4)C(=O)NC5=CC(=CC=C5)Br

Isomeric SMILES

C1C(SC(=NC2=CC=C(C=C2)F)N(C1=O)CC3=CC4=C(C=C3)OCO4)C(=O)NC5=CC(=CC=C5)Br

InChI

InChI=1S/C25H19BrFN3O4S/c26-16-2-1-3-19(11-16)28-24(32)22-12-23(31)30(13-15-4-9-20-21(10-15)34-14-33-20)25(35-22)29-18-7-5-17(27)6-8-18/h1-11,22H,12-14H2,(H,28,32)