5-(azepan-1-ylsulfonyl)-N-(1,3-benzothiazol-2-ylmethyl)-2-methoxy-N-methyl-benzamide

Systemtic Name: 5-(azepan-1-ylsulfonyl)-N-(1,3-benzothiazol-2-ylmethyl)-2-methoxy-N-methyl-benzamide Openeye Name: 5-(azepan-1-ylsulfonyl)-N-(1,3-benzothiazol-2-ylmethyl)-2-methoxy-N-methyl-benzamide CAS Name: 5-(1-azepanylsulfonyl)-N-(1,3-benzothiazol-2-ylmethyl)-2-methoxy-N-methylbenzamide IUPAC Name: 5-(azepan-1-ylsulfonyl)-N-(1,3-benzothiazol-2-ylmethyl)-2-methoxy-N-methylbenzamide Traditional Name: 5-(azepan-1-ylsulfonyl)-N-(1,3-benzothiazol-2-ylmethyl)-2-methoxy-N-methyl-benzamide Formula: C23H27N3O4S2 MolecularWeight: 473.60818

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=NC2=CC=CC=C2S1)C(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCCCCC4)OC

Isomeric SMILES

CN(CC1=NC2=CC=CC=C2S1)C(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCCCCC4)OC

InChI

InChI=1S/C23H27N3O4S2/c1-25(16-22-24-19-9-5-6-10-21(19)31-22)23(27)18-15-17(11-12-20(18)30-2)32(28,29)26-13-7-3-4-8-14-26/h5-6,9-12,15H,3-4,7-8,13-14,16H2,1-2H3