ethyl 2,6-dimethyl-5-[[(4-morpholin-4-ylsulfonyl-2-nitro-phenyl)amino]carbamoylamino]pyridine-3-carboxylate

Systemtic Name: ethyl 2,6-dimethyl-5-[[(4-morpholin-4-ylsulfonyl-2-nitro-phenyl)amino]carbamoylamino]pyridine-3-carboxylate Openeye Name: ethyl 2,6-dimethyl-5-[(4-morpholinosulfonyl-2-nitro-anilino)carbamoylamino]pyridine-3-carboxylate CAS Name: 2,6-dimethyl-5-[[[[4-(4-morpholinylsulfonyl)-2-nitrophenyl]hydrazo]-oxomethyl]amino]-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 2,6-dimethyl-5-[(4-morpholin-4-ylsulfonyl-2-nitroanilino)carbamoylamino]pyridine-3-carboxylate Traditional Name: 2,6-dimethyl-5-[(4-morpholinosulfonyl-2-nitro-anilino)carbamoylamino]nicotinic acid ethyl ester Formula: C21H26N6O8S MolecularWeight: 522.53154

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(N=C1C)C)NC(=O)NNC2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=C(N=C1C)C)NC(=O)NNC2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)[N+](=O)[O-]

InChI

InChI=1S/C21H26N6O8S/c1-4-35-20(28)16-12-18(14(3)22-13(16)2)23-21(29)25-24-17-6-5-15(11-19(17)27(30)31)36(32,33)26-7-9-34-10-8-26/h5-6,11-12,24H,4,7-10H2,1-3H3,(H2,23,25,29)