dimethyl 4-(dimethylamino)-2-(2,3-dinitro-6-phenylazanyl-phenyl)-4H-1,3-thiazine-5,6-dicarboxylate

Systemtic Name: dimethyl 4-(dimethylamino)-2-(2,3-dinitro-6-phenylazanyl-phenyl)-4H-1,3-thiazine-5,6-dicarboxylate Openeye Name: dimethyl 2-(6-anilino-2,3-dinitro-phenyl)-4-(dimethylamino)-4H-1,3-thiazine-5,6-dicarboxylate CAS Name: 2-(6-anilino-2,3-dinitrophenyl)-4-(dimethylamino)-4H-1,3-thiazine-5,6-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-(6-anilino-2,3-dinitrophenyl)-4-(dimethylamino)-4H-1,3-thiazine-5,6-dicarboxylate Traditional Name: 2-(6-anilino-2,3-dinitro-phenyl)-4-(dimethylamino)-4H-1,3-thiazine-5,6-dicarboxylic acid dimethyl ester Formula: C22H21N5O8S MolecularWeight: 515.49584

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1C(=C(SC(=N1)C2=C(C=CC(=C2[N+](=O)[O-])[N+](=O)[O-])NC3=CC=CC=C3)C(=O)OC)C(=O)OC

Isomeric SMILES

CN(C)C1C(=C(SC(=N1)C2=C(C=CC(=C2[N+](=O)[O-])[N+](=O)[O-])NC3=CC=CC=C3)C(=O)OC)C(=O)OC

InChI

InChI=1S/C22H21N5O8S/c1-25(2)19-16(21(28)34-3)18(22(29)35-4)36-20(24-19)15-13(23-12-8-6-5-7-9-12)10-11-14(26(30)31)17(15)27(32)33/h5-11,19,23H,1-4H3