N-(4,5-dimethyl-1,3-benzothiazol-2-yl)-3-methylsulfonyl-N-(pyridin-2-ylmethyl)benzamide

Systemtic Name: N-(4,5-dimethyl-1,3-benzothiazol-2-yl)-3-methylsulfonyl-N-(pyridin-2-ylmethyl)benzamide Openeye Name: N-(4,5-dimethyl-1,3-benzothiazol-2-yl)-3-methylsulfonyl-N-(2-pyridylmethyl)benzamide CAS Name: N-(4,5-dimethyl-1,3-benzothiazol-2-yl)-3-methylsulfonyl-N-(2-pyridinylmethyl)benzamide IUPAC Name: N-(4,5-dimethyl-1,3-benzothiazol-2-yl)-3-methylsulfonyl-N-(pyridin-2-ylmethyl)benzamide Traditional Name: N-(4,5-dimethyl-1,3-benzothiazol-2-yl)-3-mesyl-N-(2-pyridylmethyl)benzamide Formula: C23H21N3O3S2 MolecularWeight: 451.56114

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)SC(=N2)N(CC3=CC=CC=N3)C(=O)C4=CC(=CC=C4)S(=O)(=O)C)C

Isomeric SMILES

CC1=C(C2=C(C=C1)SC(=N2)N(CC3=CC=CC=N3)C(=O)C4=CC(=CC=C4)S(=O)(=O)C)C

InChI

InChI=1S/C23H21N3O3S2/c1-15-10-11-20-21(16(15)2)25-23(30-20)26(14-18-8-4-5-12-24-18)22(27)17-7-6-9-19(13-17)31(3,28)29/h4-13H,14H2,1-3H3