N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-4-(2-oxidanylidenepiperidin-1-yl)benzamide

Systemtic Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-4-(2-oxidanylidenepiperidin-1-yl)benzamide Openeye Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-4-(2-oxo-1-piperidyl)benzamide CAS Name: N-[5-(1-azepanylsulfonyl)-2-methoxyphenyl]-4-(2-oxo-1-piperidinyl)benzamide IUPAC Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxyphenyl]-4-(2-oxopiperidin-1-yl)benzamide Traditional Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-4-(2-ketopiperidino)benzamide Formula: C25H31N3O5S MolecularWeight: 485.59574

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)NC(=O)C3=CC=C(C=C3)N4CCCCC4=O

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)NC(=O)C3=CC=C(C=C3)N4CCCCC4=O

InChI

InChI=1S/C25H31N3O5S/c1-33-23-14-13-21(34(31,32)27-15-5-2-3-6-16-27)18-22(23)26-25(30)19-9-11-20(12-10-19)28-17-7-4-8-24(28)29/h9-14,18H,2-8,15-17H2,1H3,(H,26,30)