3-(1,3-dihydroisoindol-2-ylsulfonyl)-N-(2,2-dimethylpropyl)-4-(methylamino)benzamide

Systemtic Name: 3-(1,3-dihydroisoindol-2-ylsulfonyl)-N-(2,2-dimethylpropyl)-4-(methylamino)benzamide Openeye Name: N-(2,2-dimethylpropyl)-3-isoindolin-2-ylsulfonyl-4-(methylamino)benzamide CAS Name: 3-(1,3-dihydroisoindol-2-ylsulfonyl)-N-(2,2-dimethylpropyl)-4-(methylamino)benzamide IUPAC Name: 3-(1,3-dihydroisoindol-2-ylsulfonyl)-N-(2,2-dimethylpropyl)-4-(methylamino)benzamide Traditional Name: 3-isoindolin-2-ylsulfonyl-4-(methylamino)-N-neopentyl-benzamide Formula: C21H27N3O3S MolecularWeight: 401.52238

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CNC(=O)C1=CC(=C(C=C1)NC)S(=O)(=O)N2CC3=CC=CC=C3C2

Isomeric SMILES

CC(C)(C)CNC(=O)C1=CC(=C(C=C1)NC)S(=O)(=O)N2CC3=CC=CC=C3C2

InChI

InChI=1S/C21H27N3O3S/c1-21(2,3)14-23-20(25)15-9-10-18(22-4)19(11-15)28(26,27)24-12-16-7-5-6-8-17(16)13-24/h5-11,22H,12-14H2,1-4H3,(H,23,25)