5-(azepan-1-ylsulfonyl)-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-2-methoxy-benzamide

Systemtic Name: 5-(azepan-1-ylsulfonyl)-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-2-methoxy-benzamide Openeye Name: 5-(azepan-1-ylsulfonyl)-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-2-methoxy-benzamide CAS Name: 5-(1-azepanylsulfonyl)-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-2-methoxybenzamide IUPAC Name: 5-(azepan-1-ylsulfonyl)-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-2-methoxybenzamide Traditional Name: 5-(azepan-1-ylsulfonyl)-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-2-methoxy-benzamide Formula: C23H27N3O4S2 MolecularWeight: 473.60818

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)SC(=N2)NC(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCCCCC4)OC)C

Isomeric SMILES

CC1=CC(=C2C(=C1)SC(=N2)NC(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCCCCC4)OC)C

InChI

InChI=1S/C23H27N3O4S2/c1-15-12-16(2)21-20(13-15)31-23(24-21)25-22(27)18-14-17(8-9-19(18)30-3)32(28,29)26-10-6-4-5-7-11-26/h8-9,12-14H,4-7,10-11H2,1-3H3,(H,24,25,27)