(4-morpholin-4-yl-3-nitro-phenyl)-(2-morpholin-4-yl-4-thiophen-2-yl-1,3-thiazol-5-yl)methanone

Systemtic Name: (4-morpholin-4-yl-3-nitro-phenyl)-(2-morpholin-4-yl-4-thiophen-2-yl-1,3-thiazol-5-yl)methanone Openeye Name: (4-morpholino-3-nitro-phenyl)-[2-morpholino-4-(2-thienyl)thiazol-5-yl]methanone CAS Name: [4-(4-morpholinyl)-3-nitrophenyl]-[2-(4-morpholinyl)-4-thiophen-2-yl-5-thiazolyl]methanone IUPAC Name: (4-morpholin-4-yl-3-nitrophenyl)-(2-morpholin-4-yl-4-thiophen-2-yl-1,3-thiazol-5-yl)methanone Traditional Name: (4-morpholino-3-nitro-phenyl)-[2-morpholino-4-(2-thienyl)thiazol-5-yl]methanone Formula: C22H22N4O5S2 MolecularWeight: 486.56388

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)C(=O)C3=C(N=C(S3)N4CCOCC4)C5=CC=CS5)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)C(=O)C3=C(N=C(S3)N4CCOCC4)C5=CC=CS5)[N+](=O)[O-]

InChI

InChI=1S/C22H22N4O5S2/c27-20(15-3-4-16(17(14-15)26(28)29)24-5-9-30-10-6-24)21-19(18-2-1-13-32-18)23-22(33-21)25-7-11-31-12-8-25/h1-4,13-14H,5-12H2