4-bromanyl-N-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)-3-nitro-benzamide

Systemtic Name: 4-bromanyl-N-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)-3-nitro-benzamide Openeye Name: 4-bromo-N-(2-morpholino-1,3-benzothiazol-6-yl)-3-nitro-benzamide CAS Name: 4-bromo-N-[2-(4-morpholinyl)-1,3-benzothiazol-6-yl]-3-nitrobenzamide IUPAC Name: 4-bromo-N-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)-3-nitrobenzamide Traditional Name: 4-bromo-N-(2-morpholino-1,3-benzothiazol-6-yl)-3-nitro-benzamide Formula: C18H15BrN4O4S MolecularWeight: 463.3051

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=NC3=C(S2)C=C(C=C3)NC(=O)C4=CC(=C(C=C4)Br)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C2=NC3=C(S2)C=C(C=C3)NC(=O)C4=CC(=C(C=C4)Br)[N+](=O)[O-]

InChI

InChI=1S/C18H15BrN4O4S/c19-13-3-1-11(9-15(13)23(25)26)17(24)20-12-2-4-14-16(10-12)28-18(21-14)22-5-7-27-8-6-22/h1-4,9-10H,5-8H2,(H,20,24)