5-chloranyl-N-(6-morpholin-4-ylsulfonyl-1,3-benzothiazol-2-yl)-2-nitro-benzamide

Systemtic Name: 5-chloranyl-N-(6-morpholin-4-ylsulfonyl-1,3-benzothiazol-2-yl)-2-nitro-benzamide Openeye Name: 5-chloro-N-(6-morpholinosulfonyl-1,3-benzothiazol-2-yl)-2-nitro-benzamide CAS Name: 5-chloro-N-[6-(4-morpholinylsulfonyl)-1,3-benzothiazol-2-yl]-2-nitrobenzamide IUPAC Name: 5-chloro-N-(6-morpholin-4-ylsulfonyl-1,3-benzothiazol-2-yl)-2-nitrobenzamide Traditional Name: 5-chloro-N-(6-morpholinosulfonyl-1,3-benzothiazol-2-yl)-2-nitro-benzamide Formula: C18H15ClN4O6S2 MolecularWeight: 482.9179

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC3=C(C=C2)N=C(S3)NC(=O)C4=C(C=CC(=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC3=C(C=C2)N=C(S3)NC(=O)C4=C(C=CC(=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H15ClN4O6S2/c19-11-1-4-15(23(25)26)13(9-11)17(24)21-18-20-14-3-2-12(10-16(14)30-18)31(27,28)22-5-7-29-8-6-22/h1-4,9-10H,5-8H2,(H,20,21,24)