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

Systemtic Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-2-[ethyl(2-methylprop-2-enyl)amino]ethanamide Openeye Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-2-[ethyl(2-methylallyl)amino]acetamide CAS Name: N-[3-(1-azepanylsulfonyl)-4-methylphenyl]-2-[ethyl(2-methylprop-2-enyl)amino]acetamide IUPAC Name: N-[3-(azepan-1-ylsulfonyl)-4-methylphenyl]-2-[ethyl(2-methylprop-2-enyl)amino]acetamide Traditional Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-2-[ethyl(2-methylallyl)amino]acetamide Formula: C21H33N3O3S MolecularWeight: 407.57002

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=C)C)CC(=O)NC1=CC(=C(C=C1)C)S(=O)(=O)N2CCCCCC2

Isomeric SMILES

CCN(CC(=C)C)CC(=O)NC1=CC(=C(C=C1)C)S(=O)(=O)N2CCCCCC2

InChI

InChI=1S/C21H33N3O3S/c1-5-23(15-17(2)3)16-21(25)22-19-11-10-18(4)20(14-19)28(26,27)24-12-8-6-7-9-13-24/h10-11,14H,2,5-9,12-13,15-16H2,1,3-4H3,(H,22,25)