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

Systemtic Name: N-(4,5-dimethyl-1,3-benzothiazol-2-yl)-3-propan-2-ylsulfonyl-N-(pyridin-2-ylmethyl)benzamide Openeye Name: N-(4,5-dimethyl-1,3-benzothiazol-2-yl)-3-isopropylsulfonyl-N-(2-pyridylmethyl)benzamide CAS Name: N-(4,5-dimethyl-1,3-benzothiazol-2-yl)-3-propan-2-ylsulfonyl-N-(2-pyridinylmethyl)benzamide IUPAC Name: N-(4,5-dimethyl-1,3-benzothiazol-2-yl)-3-propan-2-ylsulfonyl-N-(pyridin-2-ylmethyl)benzamide Traditional Name: N-(4,5-dimethyl-1,3-benzothiazol-2-yl)-3-isopropylsulfonyl-N-(2-pyridylmethyl)benzamide Formula: C25H25N3O3S2 MolecularWeight: 479.6143

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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)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)C)C

InChI

InChI=1S/C25H25N3O3S2/c1-16(2)33(30,31)21-10-7-8-19(14-21)24(29)28(15-20-9-5-6-13-26-20)25-27-23-18(4)17(3)11-12-22(23)32-25/h5-14,16H,15H2,1-4H3