N-[(1R)-4,5-dimethyl-2-(4-nitrophenyl)carbonyl-3,6-dihydro-1,2-thiazin-1-ylidene]-4-nitro-benzamide

Systemtic Name: N-[(1R)-4,5-dimethyl-2-(4-nitrophenyl)carbonyl-3,6-dihydro-1,2-thiazin-1-ylidene]-4-nitro-benzamide Openeye Name: N-[(1R)-4,5-dimethyl-2-(4-nitrobenzoyl)-3,6-dihydrothiazin-1-ylidene]-4-nitro-benzamide CAS Name: N-[(1R)-4,5-dimethyl-2-[(4-nitrophenyl)-oxomethyl]-3,6-dihydrothiazin-1-ylidene]-4-nitrobenzamide IUPAC Name: N-[(1R)-4,5-dimethyl-2-(4-nitrobenzoyl)-3,6-dihydrothiazin-1-ylidene]-4-nitrobenzamide Traditional Name: N-[(1R)-4,5-dimethyl-2-(4-nitrobenzoyl)-3,6-dihydrothiazin-1-ylidene]-4-nitro-benzamide Formula: C20H18N4O6S MolecularWeight: 442.44512

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(CS(=NC(=O)C2=CC=C(C=C2)[N+](=O)[O-])N(C1)C(=O)C3=CC=C(C=C3)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C[S@](=NC(=O)C2=CC=C(C=C2)[N+](=O)[O-])N(C1)C(=O)C3=CC=C(C=C3)[N+](=O)[O-])C

InChI

InChI=1S/C20H18N4O6S/c1-13-11-22(20(26)16-5-9-18(10-6-16)24(29)30)31(12-14(13)2)21-19(25)15-3-7-17(8-4-15)23(27)28/h3-10H,11-12H2,1-2H3/t31-/m1/s1