N-[2-(azepan-1-yl)ethyl]-5-(3,4-dimethyl-1,2-oxazol-5-yl)-2-methyl-benzenesulfonamide

Systemtic Name: N-[2-(azepan-1-yl)ethyl]-5-(3,4-dimethyl-1,2-oxazol-5-yl)-2-methyl-benzenesulfonamide Openeye Name: N-[2-(azepan-1-yl)ethyl]-5-(3,4-dimethylisoxazol-5-yl)-2-methyl-benzenesulfonamide CAS Name: N-[2-(1-azepanyl)ethyl]-5-(3,4-dimethyl-5-isoxazolyl)-2-methylbenzenesulfonamide IUPAC Name: N-[2-(azepan-1-yl)ethyl]-5-(3,4-dimethyl-1,2-oxazol-5-yl)-2-methylbenzenesulfonamide Traditional Name: N-[2-(azepan-1-yl)ethyl]-5-(3,4-dimethylisoxazol-5-yl)-2-methyl-benzenesulfonamide Formula: C20H29N3O3S MolecularWeight: 391.52756

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=C(C(=NO2)C)C)S(=O)(=O)NCCN3CCCCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)C2=C(C(=NO2)C)C)S(=O)(=O)NCCN3CCCCCC3

InChI

InChI=1S/C20H29N3O3S/c1-15-8-9-18(20-16(2)17(3)22-26-20)14-19(15)27(24,25)21-10-13-23-11-6-4-5-7-12-23/h8-9,14,21H,4-7,10-13H2,1-3H3