N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-3-methylsulfonyl-N-(pyridin-3-ylmethyl)benzamide

Systemtic Name: N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-3-methylsulfonyl-N-(pyridin-3-ylmethyl)benzamide Openeye Name: N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-3-methylsulfonyl-N-(3-pyridylmethyl)benzamide CAS Name: N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-3-methylsulfonyl-N-(3-pyridinylmethyl)benzamide IUPAC Name: N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-3-methylsulfonyl-N-(pyridin-3-ylmethyl)benzamide Traditional Name: N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-3-mesyl-N-(3-pyridylmethyl)benzamide Formula: C23H21N3O3S2 MolecularWeight: 451.56114

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)SC(=N2)N(CC3=CN=CC=C3)C(=O)C4=CC(=CC=C4)S(=O)(=O)C

Isomeric SMILES

CC1=CC2=C(C=C1C)SC(=N2)N(CC3=CN=CC=C3)C(=O)C4=CC(=CC=C4)S(=O)(=O)C

InChI

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