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

Systemtic Name: N-[2-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]ethyl]-4-morpholin-4-yl-3-nitro-benzamide Openeye Name: N-[2-[4-(2-methylthiazol-4-yl)phenyl]ethyl]-4-morpholino-3-nitro-benzamide CAS Name: N-[2-[4-(2-methyl-4-thiazolyl)phenyl]ethyl]-4-(4-morpholinyl)-3-nitrobenzamide IUPAC Name: N-[2-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]ethyl]-4-morpholin-4-yl-3-nitrobenzamide Traditional Name: N-[2-[4-(2-methylthiazol-4-yl)phenyl]ethyl]-4-morpholino-3-nitro-benzamide Formula: C23H24N4O4S MolecularWeight: 452.52606

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)C2=CC=C(C=C2)CCNC(=O)C3=CC(=C(C=C3)N4CCOCC4)[N+](=O)[O-]

Isomeric SMILES

CC1=NC(=CS1)C2=CC=C(C=C2)CCNC(=O)C3=CC(=C(C=C3)N4CCOCC4)[N+](=O)[O-]

InChI

InChI=1S/C23H24N4O4S/c1-16-25-20(15-32-16)18-4-2-17(3-5-18)8-9-24-23(28)19-6-7-21(22(14-19)27(29)30)26-10-12-31-13-11-26/h2-7,14-15H,8-13H2,1H3,(H,24,28)