N-[3-methyl-1-oxidanylidene-1-[[3-oxidanylidene-1-(1,3-thiazol-2-ylsulfonyl)azepan-4-yl]amino]butan-2-yl]-1-benzofuran-2-carboxamide

Systemtic Name: N-[3-methyl-1-oxidanylidene-1-[[3-oxidanylidene-1-(1,3-thiazol-2-ylsulfonyl)azepan-4-yl]amino]butan-2-yl]-1-benzofuran-2-carboxamide Openeye Name: N-[2-methyl-1-[(3-oxo-1-thiazol-2-ylsulfonyl-azepan-4-yl)carbamoyl]propyl]benzofuran-2-carboxamide CAS Name: N-[3-methyl-1-oxo-1-[[3-oxo-1-(2-thiazolylsulfonyl)-4-azepanyl]amino]butan-2-yl]-2-benzofurancarboxamide IUPAC Name: N-[3-methyl-1-oxo-1-[[3-oxo-1-(1,3-thiazol-2-ylsulfonyl)azepan-4-yl]amino]butan-2-yl]-1-benzofuran-2-carboxamide Traditional Name: N-[1-[(3-keto-1-thiazol-2-ylsulfonyl-azepan-4-yl)carbamoyl]-2-methyl-propyl]coumarilamide Formula: C23H26N4O6S2 MolecularWeight: 518.60574

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1CCCN(CC1=O)S(=O)(=O)C2=NC=CS2)NC(=O)C3=CC4=CC=CC=C4O3

Isomeric SMILES

CC(C)C(C(=O)NC1CCCN(CC1=O)S(=O)(=O)C2=NC=CS2)NC(=O)C3=CC4=CC=CC=C4O3

InChI

InChI=1S/C23H26N4O6S2/c1-14(2)20(26-21(29)19-12-15-6-3-4-8-18(15)33-19)22(30)25-16-7-5-10-27(13-17(16)28)35(31,32)23-24-9-11-34-23/h3-4,6,8-9,11-12,14,16,20H,5,7,10,13H2,1-2H3,(H,25,30)(H,26,29)