(2S)-N-[3-(azepan-1-ylsulfonyl)phenyl]-2-tert-butyl-1,2,3,4-tetrahydroacridine-9-carboxamide

Systemtic Name: (2S)-N-[3-(azepan-1-ylsulfonyl)phenyl]-2-tert-butyl-1,2,3,4-tetrahydroacridine-9-carboxamide Openeye Name: (2S)-N-[3-(azepan-1-ylsulfonyl)phenyl]-2-tert-butyl-1,2,3,4-tetrahydroacridine-9-carboxamide CAS Name: (2S)-N-[3-(1-azepanylsulfonyl)phenyl]-2-tert-butyl-1,2,3,4-tetrahydroacridine-9-carboxamide IUPAC Name: (2S)-N-[3-(azepan-1-ylsulfonyl)phenyl]-2-tert-butyl-1,2,3,4-tetrahydroacridine-9-carboxamide Traditional Name: (2S)-N-[3-(azepan-1-ylsulfonyl)phenyl]-2-tert-butyl-1,2,3,4-tetrahydroacridine-9-carboxamide Formula: C30H37N3O3S MolecularWeight: 519.69808

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC2=NC3=CC=CC=C3C(=C2C1)C(=O)NC4=CC(=CC=C4)S(=O)(=O)N5CCCCCC5

Isomeric SMILES

CC(C)(C)[C@H]1CCC2=NC3=CC=CC=C3C(=C2C1)C(=O)NC4=CC(=CC=C4)S(=O)(=O)N5CCCCCC5

InChI

InChI=1S/C30H37N3O3S/c1-30(2,3)21-15-16-27-25(19-21)28(24-13-6-7-14-26(24)32-27)29(34)31-22-11-10-12-23(20-22)37(35,36)33-17-8-4-5-9-18-33/h6-7,10-14,20-21H,4-5,8-9,15-19H2,1-3H3,(H,31,34)/t21-/m0/s1