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

Systemtic Name: N-(6-morpholin-4-ylcarbonyl-1,3-benzothiazol-2-yl)-4-nitro-benzamide Openeye Name: N-[6-(morpholine-4-carbonyl)-1,3-benzothiazol-2-yl]-4-nitro-benzamide CAS Name: N-[6-[4-morpholinyl(oxo)methyl]-1,3-benzothiazol-2-yl]-4-nitrobenzamide IUPAC Name: N-[6-(morpholine-4-carbonyl)-1,3-benzothiazol-2-yl]-4-nitrobenzamide Traditional Name: N-[6-(morpholine-4-carbonyl)-1,3-benzothiazol-2-yl]-4-nitro-benzamide Formula: C19H16N4O5S MolecularWeight: 412.41914

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)C2=CC3=C(C=C2)N=C(S3)NC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C(=O)C2=CC3=C(C=C2)N=C(S3)NC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C19H16N4O5S/c24-17(12-1-4-14(5-2-12)23(26)27)21-19-20-15-6-3-13(11-16(15)29-19)18(25)22-7-9-28-10-8-22/h1-6,11H,7-10H2,(H,20,21,24)