N-[2-(azepan-1-ylsulfonyl)ethyl]-2,2-dimethyl-N-(pyridin-4-ylmethyl)propanamide

Systemtic Name: N-[2-(azepan-1-ylsulfonyl)ethyl]-2,2-dimethyl-N-(pyridin-4-ylmethyl)propanamide Openeye Name: N-[2-(azepan-1-ylsulfonyl)ethyl]-2,2-dimethyl-N-(4-pyridylmethyl)propanamide CAS Name: N-[2-(1-azepanylsulfonyl)ethyl]-2,2-dimethyl-N-(pyridin-4-ylmethyl)propanamide IUPAC Name: N-[2-(azepan-1-ylsulfonyl)ethyl]-2,2-dimethyl-N-(pyridin-4-ylmethyl)propanamide Traditional Name: N-[2-(azepan-1-ylsulfonyl)ethyl]-2,2-dimethyl-N-(4-pyridylmethyl)propionamide Formula: C19H31N3O3S MolecularWeight: 381.53274

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)N(CCS(=O)(=O)N1CCCCCC1)CC2=CC=NC=C2

Isomeric SMILES

CC(C)(C)C(=O)N(CCS(=O)(=O)N1CCCCCC1)CC2=CC=NC=C2

InChI

InChI=1S/C19H31N3O3S/c1-19(2,3)18(23)21(16-17-8-10-20-11-9-17)14-15-26(24,25)22-12-6-4-5-7-13-22/h8-11H,4-7,12-16H2,1-3H3