N-(1,3-benzothiazol-2-yl)-2-(4-methylsulfonylphenyl)-3-(oxan-4-yl)propanamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-2-(4-methylsulfonylphenyl)-3-(oxan-4-yl)propanamide Openeye Name: N-(1,3-benzothiazol-2-yl)-2-(4-methylsulfonylphenyl)-3-tetrahydropyran-4-yl-propanamide CAS Name: N-(1,3-benzothiazol-2-yl)-2-(4-methylsulfonylphenyl)-3-(4-oxanyl)propanamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-2-(4-methylsulfonylphenyl)-3-(oxan-4-yl)propanamide Traditional Name: N-(1,3-benzothiazol-2-yl)-2-(4-mesylphenyl)-3-tetrahydropyran-4-yl-propionamide Formula: C22H24N2O4S2 MolecularWeight: 444.56696

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C(CC2CCOCC2)C(=O)NC3=NC4=CC=CC=C4S3

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C(CC2CCOCC2)C(=O)NC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C22H24N2O4S2/c1-30(26,27)17-8-6-16(7-9-17)18(14-15-10-12-28-13-11-15)21(25)24-22-23-19-4-2-3-5-20(19)29-22/h2-9,15,18H,10-14H2,1H3,(H,23,24,25)