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

Systemtic Name: 4-bromanyl-N-[4-(2-morpholin-4-yl-1,3-thiazol-4-yl)phenyl]-3-nitro-benzamide Openeye Name: 4-bromo-N-[4-(2-morpholinothiazol-4-yl)phenyl]-3-nitro-benzamide CAS Name: 4-bromo-N-[4-[2-(4-morpholinyl)-4-thiazolyl]phenyl]-3-nitrobenzamide IUPAC Name: 4-bromo-N-[4-(2-morpholin-4-yl-1,3-thiazol-4-yl)phenyl]-3-nitrobenzamide Traditional Name: 4-bromo-N-[4-(2-morpholinothiazol-4-yl)phenyl]-3-nitro-benzamide Formula: C20H17BrN4O4S MolecularWeight: 489.34238

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=NC(=CS2)C3=CC=C(C=C3)NC(=O)C4=CC(=C(C=C4)Br)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C2=NC(=CS2)C3=CC=C(C=C3)NC(=O)C4=CC(=C(C=C4)Br)[N+](=O)[O-]

InChI

InChI=1S/C20H17BrN4O4S/c21-16-6-3-14(11-18(16)25(27)28)19(26)22-15-4-1-13(2-5-15)17-12-30-20(23-17)24-7-9-29-10-8-24/h1-6,11-12H,7-10H2,(H,22,26)