AC1MXFD4 structure

AC1MXFD4

N-[3-(3-methoxyphenyl)-5,5-dioxo-3a,4,6,6a-tetrahydrothieno[3,4-d][1,3]thiazol-2-ylidene]-3-nitrobenzamide

Also Known As: VU0494324-1|(E)-N-(3-(3-methoxyphenyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)-3-nitrobenzamide|AS-871/41981395|SR-01000012493-1|F1404-0014|N-[(2E)-3-(3-methoxyphenyl)-5,5-dioxo-hexahydro-5lambda6-thieno[3,4-d][1,3]thiazol-2-ylidene]-3-nitrobenzamide|N-[3-(3-methoxyphenyl)-5,5-dioxo-3a,4,6,6a-tetrahydrothieno[3,4-d][1,3]thiazol-2-ylidene]-3-nitrobenzamide|3-nitro-N-(3-(3-methoxyphenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene)benzamide|4-(3-methoxyphenyl)-5-[2-(3-nitrophenyl)-2-oxo-1-azaethylidene]-1,3,4,6,3a,6a- hexahydro-2,6-dithia-4-azapentalene-2,2-dione|N-(3-(3-Methoxyphenyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)-3-nitrobenzamide

CAS: 618396-86-4
Molecular Formula C19H17N3O6S2
Molecular Weight 447.05588 g/mol
LogP 2.5186
Topological Polar Surface Area 119.18 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 7
Rotatable Bonds 4
Exact Mass 447.05588
Monoisotopic Mass 447.05588
Heavy Atoms 30
Complexity 1164.3646

Chemical Identifiers

CAS Number 618396-86-4
SMILES COC1=CC=CC(=C1)N2C3CS(=O)(=O)CC3SC2=NC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

Product Overview

AC1MXFD4 (CAS 618396-86-4), with molecular formula C19H17N3O6S2 and molecular weight 447.05588 g/mol. IUPAC: N-[3-(3-methoxyphenyl)-5,5-dioxo-3a,4,6,6a-tetrahydrothieno[3,4-d][1,3]thiazol-2-ylidene]-3-nitrobenzamide.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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