ethyl 2-[2-[(4-morpholin-4-yl-3-nitro-phenyl)carbonylamino]-1,3-thiazol-4-yl]ethanoate

Systemtic Name: ethyl 2-[2-[(4-morpholin-4-yl-3-nitro-phenyl)carbonylamino]-1,3-thiazol-4-yl]ethanoate Openeye Name: ethyl 2-[2-[(4-morpholino-3-nitro-benzoyl)amino]thiazol-4-yl]acetate CAS Name: 2-[2-[[[4-(4-morpholinyl)-3-nitrophenyl]-oxomethyl]amino]-4-thiazolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-[(4-morpholin-4-yl-3-nitrobenzoyl)amino]-1,3-thiazol-4-yl]acetate Traditional Name: 2-[2-[(4-morpholino-3-nitro-benzoyl)amino]thiazol-4-yl]acetic acid ethyl ester Formula: C18H20N4O6S MolecularWeight: 420.4396

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=CSC(=N1)NC(=O)C2=CC(=C(C=C2)N3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)CC1=CSC(=N1)NC(=O)C2=CC(=C(C=C2)N3CCOCC3)[N+](=O)[O-]

InChI

InChI=1S/C18H20N4O6S/c1-2-28-16(23)10-13-11-29-18(19-13)20-17(24)12-3-4-14(15(9-12)22(25)26)21-5-7-27-8-6-21/h3-4,9,11H,2,5-8,10H2,1H3,(H,19,20,24)