N-(furan-2-ylmethyl)-3-(4-methylphenyl)sulfonyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)propanamide

Systemtic Name: N-(furan-2-ylmethyl)-3-(4-methylphenyl)sulfonyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)propanamide Openeye Name: N-(2-furylmethyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-3-(p-tolylsulfonyl)propanamide CAS Name: N-(2-furanylmethyl)-3-(4-methylphenyl)sulfonyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)propanamide IUPAC Name: N-(furan-2-ylmethyl)-3-(4-methylphenyl)sulfonyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)propanamide Traditional Name: N-(2-furfuryl)-N-(6-mesyl-1,3-benzothiazol-2-yl)-3-tosyl-propionamide Formula: C23H22N2O6S3 MolecularWeight: 518.62558

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CCC(=O)N(CC2=CC=CO2)C3=NC4=C(S3)C=C(C=C4)S(=O)(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CCC(=O)N(CC2=CC=CO2)C3=NC4=C(S3)C=C(C=C4)S(=O)(=O)C

InChI

InChI=1S/C23H22N2O6S3/c1-16-5-7-18(8-6-16)34(29,30)13-11-22(26)25(15-17-4-3-12-31-17)23-24-20-10-9-19(33(2,27)28)14-21(20)32-23/h3-10,12,14H,11,13,15H2,1-2H3