5-(azepan-1-ylsulfonyl)-N-[2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl]-2-methoxy-N-methyl-benzamide

Systemtic Name: 5-(azepan-1-ylsulfonyl)-N-[2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl]-2-methoxy-N-methyl-benzamide Openeye Name: 5-(azepan-1-ylsulfonyl)-N-[2-(4-fluoroanilino)-2-oxo-ethyl]-2-methoxy-N-methyl-benzamide CAS Name: 5-(1-azepanylsulfonyl)-N-[2-(4-fluoroanilino)-2-oxoethyl]-2-methoxy-N-methylbenzamide IUPAC Name: 5-(azepan-1-ylsulfonyl)-N-[2-(4-fluoroanilino)-2-oxoethyl]-2-methoxy-N-methylbenzamide Traditional Name: 5-(azepan-1-ylsulfonyl)-N-[2-(4-fluoroanilino)-2-keto-ethyl]-2-methoxy-N-methyl-benzamide Formula: C23H28FN3O5S MolecularWeight: 477.548923

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NC1=CC=C(C=C1)F)C(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCCCC3)OC

Isomeric SMILES

CN(CC(=O)NC1=CC=C(C=C1)F)C(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCCCC3)OC

InChI

InChI=1S/C23H28FN3O5S/c1-26(16-22(28)25-18-9-7-17(24)8-10-18)23(29)20-15-19(11-12-21(20)32-2)33(30,31)27-13-5-3-4-6-14-27/h7-12,15H,3-6,13-14,16H2,1-2H3,(H,25,28)