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

Systemtic Name: 4-(dimethylamino)-N-[4-(2-morpholin-4-yl-1,3-thiazol-4-yl)phenyl]-3-nitro-benzamide Openeye Name: 4-(dimethylamino)-N-[4-(2-morpholinothiazol-4-yl)phenyl]-3-nitro-benzamide CAS Name: 4-(dimethylamino)-N-[4-[2-(4-morpholinyl)-4-thiazolyl]phenyl]-3-nitrobenzamide IUPAC Name: 4-(dimethylamino)-N-[4-(2-morpholin-4-yl-1,3-thiazol-4-yl)phenyl]-3-nitrobenzamide Traditional Name: 4-(dimethylamino)-N-[4-(2-morpholinothiazol-4-yl)phenyl]-3-nitro-benzamide Formula: C22H23N5O4S MolecularWeight: 453.51412

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)C3=CSC(=N3)N4CCOCC4)[N+](=O)[O-]

Isomeric SMILES

CN(C)C1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)C3=CSC(=N3)N4CCOCC4)[N+](=O)[O-]

InChI

InChI=1S/C22H23N5O4S/c1-25(2)19-8-5-16(13-20(19)27(29)30)21(28)23-17-6-3-15(4-7-17)18-14-32-22(24-18)26-9-11-31-12-10-26/h3-8,13-14H,9-12H2,1-2H3,(H,23,28)