N-(4-methyl-1,3-benzothiazol-2-yl)-2-(phenylmethyl)sulfonyl-N-(pyridin-2-ylmethyl)ethanamide

Systemtic Name: N-(4-methyl-1,3-benzothiazol-2-yl)-2-(phenylmethyl)sulfonyl-N-(pyridin-2-ylmethyl)ethanamide Openeye Name: 2-benzylsulfonyl-N-(4-methyl-1,3-benzothiazol-2-yl)-N-(2-pyridylmethyl)acetamide CAS Name: N-(4-methyl-1,3-benzothiazol-2-yl)-2-(phenylmethyl)sulfonyl-N-(2-pyridinylmethyl)acetamide IUPAC Name: 2-benzylsulfonyl-N-(4-methyl-1,3-benzothiazol-2-yl)-N-(pyridin-2-ylmethyl)acetamide Traditional Name: 2-benzylsulfonyl-N-(4-methyl-1,3-benzothiazol-2-yl)-N-(2-pyridylmethyl)acetamide Formula: C23H21N3O3S2 MolecularWeight: 451.56114

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)SC(=N2)N(CC3=CC=CC=N3)C(=O)CS(=O)(=O)CC4=CC=CC=C4

Isomeric SMILES

CC1=C2C(=CC=C1)SC(=N2)N(CC3=CC=CC=N3)C(=O)CS(=O)(=O)CC4=CC=CC=C4

InChI

InChI=1S/C23H21N3O3S2/c1-17-8-7-12-20-22(17)25-23(30-20)26(14-19-11-5-6-13-24-19)21(27)16-31(28,29)15-18-9-3-2-4-10-18/h2-13H,14-16H2,1H3