N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-2-(4-propan-2-ylsulfonylphenyl)-N-(pyridin-3-ylmethyl)ethanamide

Systemtic Name: N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-2-(4-propan-2-ylsulfonylphenyl)-N-(pyridin-3-ylmethyl)ethanamide Openeye Name: N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-2-(4-isopropylsulfonylphenyl)-N-(3-pyridylmethyl)acetamide CAS Name: N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-2-(4-propan-2-ylsulfonylphenyl)-N-(3-pyridinylmethyl)acetamide IUPAC Name: N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-2-(4-propan-2-ylsulfonylphenyl)-N-(pyridin-3-ylmethyl)acetamide Traditional Name: N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-2-(4-isopropylsulfonylphenyl)-N-(3-pyridylmethyl)acetamide Formula: C26H27N3O3S2 MolecularWeight: 493.64088

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)SC(=N2)N(CC3=CN=CC=C3)C(=O)CC4=CC=C(C=C4)S(=O)(=O)C(C)C

Isomeric SMILES

CC1=CC2=C(C=C1C)SC(=N2)N(CC3=CN=CC=C3)C(=O)CC4=CC=C(C=C4)S(=O)(=O)C(C)C

InChI

InChI=1S/C26H27N3O3S2/c1-17(2)34(31,32)22-9-7-20(8-10-22)14-25(30)29(16-21-6-5-11-27-15-21)26-28-23-12-18(3)19(4)13-24(23)33-26/h5-13,15,17H,14,16H2,1-4H3