N-(6-methyl-1,3-benzothiazol-2-yl)-4-methylsulfonyl-N-(pyridin-2-ylmethyl)benzamide

Systemtic Name: N-(6-methyl-1,3-benzothiazol-2-yl)-4-methylsulfonyl-N-(pyridin-2-ylmethyl)benzamide Openeye Name: N-(6-methyl-1,3-benzothiazol-2-yl)-4-methylsulfonyl-N-(2-pyridylmethyl)benzamide CAS Name: N-(6-methyl-1,3-benzothiazol-2-yl)-4-methylsulfonyl-N-(2-pyridinylmethyl)benzamide IUPAC Name: N-(6-methyl-1,3-benzothiazol-2-yl)-4-methylsulfonyl-N-(pyridin-2-ylmethyl)benzamide Traditional Name: 4-mesyl-N-(6-methyl-1,3-benzothiazol-2-yl)-N-(2-pyridylmethyl)benzamide Formula: C22H19N3O3S2 MolecularWeight: 437.53456

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)N(CC3=CC=CC=N3)C(=O)C4=CC=C(C=C4)S(=O)(=O)C

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)N(CC3=CC=CC=N3)C(=O)C4=CC=C(C=C4)S(=O)(=O)C

InChI

InChI=1S/C22H19N3O3S2/c1-15-6-11-19-20(13-15)29-22(24-19)25(14-17-5-3-4-12-23-17)21(26)16-7-9-18(10-8-16)30(2,27)28/h3-13H,14H2,1-2H3