5-[(4-chloranyl-3-methyl-phenoxy)methyl]-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)furan-2-carboxamide

Systemtic Name: 5-[(4-chloranyl-3-methyl-phenoxy)methyl]-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)furan-2-carboxamide Openeye Name: 5-[(4-chloro-3-methyl-phenoxy)methyl]-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)furan-2-carboxamide CAS Name: 5-[(4-chloro-3-methylphenoxy)methyl]-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-2-furancarboxamide IUPAC Name: 5-[(4-chloro-3-methylphenoxy)methyl]-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)furan-2-carboxamide Traditional Name: 5-[(4-chloro-3-methyl-phenoxy)methyl]-N-(6-mesyl-1,3-benzothiazol-2-yl)-2-furamide Formula: C21H17ClN2O5S2 MolecularWeight: 476.95308

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC2=CC=C(O2)C(=O)NC3=NC4=C(S3)C=C(C=C4)S(=O)(=O)C)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OCC2=CC=C(O2)C(=O)NC3=NC4=C(S3)C=C(C=C4)S(=O)(=O)C)Cl

InChI

InChI=1S/C21H17ClN2O5S2/c1-12-9-13(3-6-16(12)22)28-11-14-4-8-18(29-14)20(25)24-21-23-17-7-5-15(31(2,26)27)10-19(17)30-21/h3-10H,11H2,1-2H3,(H,23,24,25)