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

Systemtic Name: N-[4-[4-(azepan-1-ylsulfonyl)phenyl]-1,3-thiazol-2-yl]-5-ethyl-3-methyl-1-benzofuran-2-carboxamide Openeye Name: N-[4-[4-(azepan-1-ylsulfonyl)phenyl]thiazol-2-yl]-5-ethyl-3-methyl-benzofuran-2-carboxamide CAS Name: N-[4-[4-(1-azepanylsulfonyl)phenyl]-2-thiazolyl]-5-ethyl-3-methyl-2-benzofurancarboxamide IUPAC Name: N-[4-[4-(azepan-1-ylsulfonyl)phenyl]-1,3-thiazol-2-yl]-5-ethyl-3-methyl-1-benzofuran-2-carboxamide Traditional Name: N-[4-[4-(azepan-1-ylsulfonyl)phenyl]thiazol-2-yl]-5-ethyl-3-methyl-coumarilamide Formula: C27H29N3O4S2 MolecularWeight: 523.66686

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)OC(=C2C)C(=O)NC3=NC(=CS3)C4=CC=C(C=C4)S(=O)(=O)N5CCCCCC5

Isomeric SMILES

CCC1=CC2=C(C=C1)OC(=C2C)C(=O)NC3=NC(=CS3)C4=CC=C(C=C4)S(=O)(=O)N5CCCCCC5

InChI

InChI=1S/C27H29N3O4S2/c1-3-19-8-13-24-22(16-19)18(2)25(34-24)26(31)29-27-28-23(17-35-27)20-9-11-21(12-10-20)36(32,33)30-14-6-4-5-7-15-30/h8-13,16-17H,3-7,14-15H2,1-2H3,(H,28,29,31)