3-(azepan-1-ylsulfonyl)-N-[5-[(3-methoxyphenyl)methyl]-1,3-thiazol-2-yl]benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-N-[5-[(3-methoxyphenyl)methyl]-1,3-thiazol-2-yl]benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-N-[5-[(3-methoxyphenyl)methyl]thiazol-2-yl]benzamide CAS Name: 3-(1-azepanylsulfonyl)-N-[5-[(3-methoxyphenyl)methyl]-2-thiazolyl]benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-N-[5-[(3-methoxyphenyl)methyl]-1,3-thiazol-2-yl]benzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-N-(5-m-anisylthiazol-2-yl)benzamide Formula: C24H27N3O4S2 MolecularWeight: 485.61888

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CC2=CN=C(S2)NC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

COC1=CC=CC(=C1)CC2=CN=C(S2)NC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C24H27N3O4S2/c1-31-20-10-6-8-18(14-20)15-21-17-25-24(32-21)26-23(28)19-9-7-11-22(16-19)33(29,30)27-12-4-2-3-5-13-27/h6-11,14,16-17H,2-5,12-13,15H2,1H3,(H,25,26,28)