N-[4-[(2,6-dimethylmorpholin-4-yl)methyl]-1,3-thiazol-2-yl]-3-methyl-2-nitro-benzamide

Systemtic Name: N-[4-[(2,6-dimethylmorpholin-4-yl)methyl]-1,3-thiazol-2-yl]-3-methyl-2-nitro-benzamide Openeye Name: N-[4-[(2,6-dimethylmorpholin-4-yl)methyl]thiazol-2-yl]-3-methyl-2-nitro-benzamide CAS Name: N-[4-[(2,6-dimethyl-4-morpholinyl)methyl]-2-thiazolyl]-3-methyl-2-nitrobenzamide IUPAC Name: N-[4-[(2,6-dimethylmorpholin-4-yl)methyl]-1,3-thiazol-2-yl]-3-methyl-2-nitrobenzamide Traditional Name: N-[4-[(2,6-dimethylmorpholino)methyl]thiazol-2-yl]-3-methyl-2-nitro-benzamide Formula: C18H22N4O4S MolecularWeight: 390.45668

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(O1)C)CC2=CSC(=N2)NC(=O)C3=C(C(=CC=C3)C)[N+](=O)[O-]

Isomeric SMILES

CC1CN(CC(O1)C)CC2=CSC(=N2)NC(=O)C3=C(C(=CC=C3)C)[N+](=O)[O-]

InChI

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