1-(azepan-1-ylsulfonyl)-N-(2,4,6-trimethylphenyl)piperidine-3-carboxamide

Systemtic Name: 1-(azepan-1-ylsulfonyl)-N-(2,4,6-trimethylphenyl)piperidine-3-carboxamide Openeye Name: 1-(azepan-1-ylsulfonyl)-N-(2,4,6-trimethylphenyl)piperidine-3-carboxamide CAS Name: 1-(1-azepanylsulfonyl)-N-(2,4,6-trimethylphenyl)-3-piperidinecarboxamide IUPAC Name: 1-(azepan-1-ylsulfonyl)-N-(2,4,6-trimethylphenyl)piperidine-3-carboxamide Traditional Name: 1-(azepan-1-ylsulfonyl)-N-mesityl-nipecotamide Formula: C21H33N3O3S MolecularWeight: 407.57002

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=O)C2CCCN(C2)S(=O)(=O)N3CCCCCC3)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=O)C2CCCN(C2)S(=O)(=O)N3CCCCCC3)C

InChI

InChI=1S/C21H33N3O3S/c1-16-13-17(2)20(18(3)14-16)22-21(25)19-9-8-12-24(15-19)28(26,27)23-10-6-4-5-7-11-23/h13-14,19H,4-12,15H2,1-3H3,(H,22,25)