N-[4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]-4-morpholin-4-yl-3-nitro-benzamide

Systemtic Name: N-[4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]-4-morpholin-4-yl-3-nitro-benzamide Openeye Name: N-[4-(4-ethoxyphenyl)thiazol-2-yl]-4-morpholino-3-nitro-benzamide CAS Name: N-[4-(4-ethoxyphenyl)-2-thiazolyl]-4-(4-morpholinyl)-3-nitrobenzamide IUPAC Name: N-[4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]-4-morpholin-4-yl-3-nitrobenzamide Traditional Name: 4-morpholino-3-nitro-N-(4-p-phenetylthiazol-2-yl)benzamide Formula: C22H22N4O5S MolecularWeight: 454.49888

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=CC(=C(C=C3)N4CCOCC4)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=CC(=C(C=C3)N4CCOCC4)[N+](=O)[O-]

InChI

InChI=1S/C22H22N4O5S/c1-2-31-17-6-3-15(4-7-17)18-14-32-22(23-18)24-21(27)16-5-8-19(20(13-16)26(28)29)25-9-11-30-12-10-25/h3-8,13-14H,2,9-12H2,1H3,(H,23,24,27)