N-[3-(azepan-1-yl)propyl]-3-[(4-methylphenyl)methylsulfonyl]propanamide

Systemtic Name: N-[3-(azepan-1-yl)propyl]-3-[(4-methylphenyl)methylsulfonyl]propanamide Openeye Name: N-[3-(azepan-1-yl)propyl]-3-(p-tolylmethylsulfonyl)propanamide CAS Name: N-[3-(1-azepanyl)propyl]-3-[(4-methylphenyl)methylsulfonyl]propanamide IUPAC Name: N-[3-(azepan-1-yl)propyl]-3-[(4-methylphenyl)methylsulfonyl]propanamide Traditional Name: N-[3-(azepan-1-yl)propyl]-3-(4-methylbenzyl)sulfonyl-propionamide Formula: C20H32N2O3S MolecularWeight: 380.54468

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CS(=O)(=O)CCC(=O)NCCCN2CCCCCC2

Isomeric SMILES

CC1=CC=C(C=C1)CS(=O)(=O)CCC(=O)NCCCN2CCCCCC2

InChI

InChI=1S/C20H32N2O3S/c1-18-7-9-19(10-8-18)17-26(24,25)16-11-20(23)21-12-6-15-22-13-4-2-3-5-14-22/h7-10H,2-6,11-17H2,1H3,(H,21,23)