2-[[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]amino]-N-(1-cyanocyclohexyl)ethanamide

Systemtic Name: 2-[[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]amino]-N-(1-cyanocyclohexyl)ethanamide Openeye Name: 2-[3-(azepan-1-ylsulfonyl)-4-methyl-anilino]-N-(1-cyanocyclohexyl)acetamide CAS Name: 2-[3-(1-azepanylsulfonyl)-4-methylanilino]-N-(1-cyanocyclohexyl)acetamide IUPAC Name: 2-[3-(azepan-1-ylsulfonyl)-4-methylanilino]-N-(1-cyanocyclohexyl)acetamide Traditional Name: 2-[3-(azepan-1-ylsulfonyl)-4-methyl-anilino]-N-(1-cyanocyclohexyl)acetamide Formula: C22H32N4O3S MolecularWeight: 432.57948

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NCC(=O)NC2(CCCCC2)C#N)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)NCC(=O)NC2(CCCCC2)C#N)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C22H32N4O3S/c1-18-9-10-19(15-20(18)30(28,29)26-13-7-2-3-8-14-26)24-16-21(27)25-22(17-23)11-5-4-6-12-22/h9-10,15,24H,2-8,11-14,16H2,1H3,(H,25,27)