N-(4-tert-butyl-1,3-thiazol-2-yl)-4-morpholin-4-yl-3-nitro-benzamide

Systemtic Name: N-(4-tert-butyl-1,3-thiazol-2-yl)-4-morpholin-4-yl-3-nitro-benzamide Openeye Name: N-(4-tert-butylthiazol-2-yl)-4-morpholino-3-nitro-benzamide CAS Name: N-(4-tert-butyl-2-thiazolyl)-4-(4-morpholinyl)-3-nitrobenzamide IUPAC Name: N-(4-tert-butyl-1,3-thiazol-2-yl)-4-morpholin-4-yl-3-nitrobenzamide Traditional Name: N-(4-tert-butylthiazol-2-yl)-4-morpholino-3-nitro-benzamide Formula: C18H22N4O4S MolecularWeight: 390.45668

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CSC(=N1)NC(=O)C2=CC(=C(C=C2)N3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CSC(=N1)NC(=O)C2=CC(=C(C=C2)N3CCOCC3)[N+](=O)[O-]

InChI

InChI=1S/C18H22N4O4S/c1-18(2,3)15-11-27-17(19-15)20-16(23)12-4-5-13(14(10-12)22(24)25)21-6-8-26-9-7-21/h4-5,10-11H,6-9H2,1-3H3,(H,19,20,23)