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

Systemtic Name: N-[4-[4-(azepan-1-ylsulfonyl)phenyl]-1,3-thiazol-2-yl]-2-(5-methyl-1-benzofuran-3-yl)ethanamide Openeye Name: N-[4-[4-(azepan-1-ylsulfonyl)phenyl]thiazol-2-yl]-2-(5-methylbenzofuran-3-yl)acetamide CAS Name: N-[4-[4-(1-azepanylsulfonyl)phenyl]-2-thiazolyl]-2-(5-methyl-3-benzofuranyl)acetamide IUPAC Name: N-[4-[4-(azepan-1-ylsulfonyl)phenyl]-1,3-thiazol-2-yl]-2-(5-methyl-1-benzofuran-3-yl)acetamide Traditional Name: N-[4-[4-(azepan-1-ylsulfonyl)phenyl]thiazol-2-yl]-2-(5-methylbenzofuran-3-yl)acetamide Formula: C26H27N3O4S2 MolecularWeight: 509.64028

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC=C2CC(=O)NC3=NC(=CS3)C4=CC=C(C=C4)S(=O)(=O)N5CCCCCC5

Isomeric SMILES

CC1=CC2=C(C=C1)OC=C2CC(=O)NC3=NC(=CS3)C4=CC=C(C=C4)S(=O)(=O)N5CCCCCC5

InChI

InChI=1S/C26H27N3O4S2/c1-18-6-11-24-22(14-18)20(16-33-24)15-25(30)28-26-27-23(17-34-26)19-7-9-21(10-8-19)35(31,32)29-12-4-2-3-5-13-29/h6-11,14,16-17H,2-5,12-13,15H2,1H3,(H,27,28,30)