4-(azepan-1-ylsulfonyl)-N-[1,3-bis(oxidanylidene)isoindol-5-yl]benzamide

Systemtic Name: 4-(azepan-1-ylsulfonyl)-N-[1,3-bis(oxidanylidene)isoindol-5-yl]benzamide Openeye Name: 4-(azepan-1-ylsulfonyl)-N-(1,3-dioxoisoindolin-5-yl)benzamide CAS Name: 4-(1-azepanylsulfonyl)-N-(1,3-dioxo-5-isoindolyl)benzamide IUPAC Name: 4-(azepan-1-ylsulfonyl)-N-(1,3-dioxoisoindol-5-yl)benzamide Traditional Name: 4-(azepan-1-ylsulfonyl)-N-(1,3-diketoisoindolin-5-yl)benzamide Formula: C21H21N3O5S MolecularWeight: 427.47354

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=CC4=C(C=C3)C(=O)NC4=O

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=CC4=C(C=C3)C(=O)NC4=O

InChI

InChI=1S/C21H21N3O5S/c25-19(22-15-7-10-17-18(13-15)21(27)23-20(17)26)14-5-8-16(9-6-14)30(28,29)24-11-3-1-2-4-12-24/h5-10,13H,1-4,11-12H2,(H,22,25)(H,23,26,27)