2-[[4-(azepan-1-ylsulfonyl)phenyl]amino]-N-(2,4,6-trimethylphenyl)ethanamide

Systemtic Name: 2-[[4-(azepan-1-ylsulfonyl)phenyl]amino]-N-(2,4,6-trimethylphenyl)ethanamide Openeye Name: 2-[4-(azepan-1-ylsulfonyl)anilino]-N-(2,4,6-trimethylphenyl)acetamide CAS Name: 2-[4-(1-azepanylsulfonyl)anilino]-N-(2,4,6-trimethylphenyl)acetamide IUPAC Name: 2-[4-(azepan-1-ylsulfonyl)anilino]-N-(2,4,6-trimethylphenyl)acetamide Traditional Name: 2-[4-(azepan-1-ylsulfonyl)anilino]-N-mesityl-acetamide Formula: C23H31N3O3S MolecularWeight: 429.57554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=O)CNC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=O)CNC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3)C

InChI

InChI=1S/C23H31N3O3S/c1-17-14-18(2)23(19(3)15-17)25-22(27)16-24-20-8-10-21(11-9-20)30(28,29)26-12-6-4-5-7-13-26/h8-11,14-15,24H,4-7,12-13,16H2,1-3H3,(H,25,27)