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

Systemtic Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-2-[cyclopropyl(2-methylpropyl)amino]ethanamide Openeye Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-2-[cyclopropyl(isobutyl)amino]acetamide CAS Name: N-[3-(1-azepanylsulfonyl)-4-methylphenyl]-2-[cyclopropyl(2-methylpropyl)amino]acetamide IUPAC Name: N-[3-(azepan-1-ylsulfonyl)-4-methylphenyl]-2-[cyclopropyl(2-methylpropyl)amino]acetamide Traditional Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-2-[cyclopropyl(isobutyl)amino]acetamide Formula: C22H35N3O3S MolecularWeight: 421.5966

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CN(CC(C)C)C2CC2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CN(CC(C)C)C2CC2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C22H35N3O3S/c1-17(2)15-24(20-10-11-20)16-22(26)23-19-9-8-18(3)21(14-19)29(27,28)25-12-6-4-5-7-13-25/h8-9,14,17,20H,4-7,10-13,15-16H2,1-3H3,(H,23,26)