ethyl 2-[(2,6-dinitro-4-phenothiazin-10-ylcarbonyl-phenyl)amino]-4-methyl-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 2-[(2,6-dinitro-4-phenothiazin-10-ylcarbonyl-phenyl)amino]-4-methyl-1,3-thiazole-5-carboxylate Openeye Name: ethyl 2-[2,6-dinitro-4-(phenothiazine-10-carbonyl)anilino]-4-methyl-thiazole-5-carboxylate CAS Name: 2-[2,6-dinitro-4-[oxo(10-phenothiazinyl)methyl]anilino]-4-methyl-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[2,6-dinitro-4-(phenothiazine-10-carbonyl)anilino]-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[2,6-dinitro-4-(phenothiazine-10-carbonyl)anilino]-4-methyl-thiazole-5-carboxylic acid ethyl ester Formula: C26H19N5O7S2 MolecularWeight: 577.58836

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(S1)NC2=C(C=C(C=C2[N+](=O)[O-])C(=O)N3C4=CC=CC=C4SC5=CC=CC=C53)[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)NC2=C(C=C(C=C2[N+](=O)[O-])C(=O)N3C4=CC=CC=C4SC5=CC=CC=C53)[N+](=O)[O-])C

InChI

InChI=1S/C26H19N5O7S2/c1-3-38-25(33)23-14(2)27-26(40-23)28-22-18(30(34)35)12-15(13-19(22)31(36)37)24(32)29-16-8-4-6-10-20(16)39-21-11-7-5-9-17(21)29/h4-13H,3H2,1-2H3,(H,27,28)