4-(1,5-dimethoxypentan-3-ylsulfonyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)benzamide

Systemtic Name: 4-(1,5-dimethoxypentan-3-ylsulfonyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)benzamide Openeye Name: 4-[3-methoxy-1-(2-methoxyethyl)propyl]sulfonyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)benzamide CAS Name: 4-(1,5-dimethoxypentan-3-ylsulfonyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)benzamide IUPAC Name: 4-(1,5-dimethoxypentan-3-ylsulfonyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)benzamide Traditional Name: N-(6-mesyl-1,3-benzothiazol-2-yl)-4-[3-methoxy-1-(2-methoxyethyl)propyl]sulfonyl-benzamide Formula: C22H26N2O7S3 MolecularWeight: 526.64604

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Descriptors Computed from Structure

Canonical SMILES:

COCCC(CCOC)S(=O)(=O)C1=CC=C(C=C1)C(=O)NC2=NC3=C(S2)C=C(C=C3)S(=O)(=O)C

Isomeric SMILES

COCCC(CCOC)S(=O)(=O)C1=CC=C(C=C1)C(=O)NC2=NC3=C(S2)C=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C22H26N2O7S3/c1-30-12-10-17(11-13-31-2)34(28,29)16-6-4-15(5-7-16)21(25)24-22-23-19-9-8-18(33(3,26)27)14-20(19)32-22/h4-9,14,17H,10-13H2,1-3H3,(H,23,24,25)