N-[4-[4-(azepan-1-ylsulfonyl)phenyl]-1,3-thiazol-2-yl]-2-(5-methoxy-1-benzofuran-3-yl)ethanamide

Systemtic Name: N-[4-[4-(azepan-1-ylsulfonyl)phenyl]-1,3-thiazol-2-yl]-2-(5-methoxy-1-benzofuran-3-yl)ethanamide Openeye Name: N-[4-[4-(azepan-1-ylsulfonyl)phenyl]thiazol-2-yl]-2-(5-methoxybenzofuran-3-yl)acetamide CAS Name: N-[4-[4-(1-azepanylsulfonyl)phenyl]-2-thiazolyl]-2-(5-methoxy-3-benzofuranyl)acetamide IUPAC Name: N-[4-[4-(azepan-1-ylsulfonyl)phenyl]-1,3-thiazol-2-yl]-2-(5-methoxy-1-benzofuran-3-yl)acetamide Traditional Name: N-[4-[4-(azepan-1-ylsulfonyl)phenyl]thiazol-2-yl]-2-(5-methoxybenzofuran-3-yl)acetamide Formula: C26H27N3O5S2 MolecularWeight: 525.63968

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)OC=C2CC(=O)NC3=NC(=CS3)C4=CC=C(C=C4)S(=O)(=O)N5CCCCCC5

Isomeric SMILES

COC1=CC2=C(C=C1)OC=C2CC(=O)NC3=NC(=CS3)C4=CC=C(C=C4)S(=O)(=O)N5CCCCCC5

InChI

InChI=1S/C26H27N3O5S2/c1-33-20-8-11-24-22(15-20)19(16-34-24)14-25(30)28-26-27-23(17-35-26)18-6-9-21(10-7-18)36(31,32)29-12-4-2-3-5-13-29/h6-11,15-17H,2-5,12-14H2,1H3,(H,27,28,30)