N-[2-[butan-2-yl(thiophen-2-ylmethyl)amino]ethyl]-2-methyl-5-(3-methyl-1,2-oxazol-5-yl)benzenesulfonamide

Systemtic Name: N-[2-[butan-2-yl(thiophen-2-ylmethyl)amino]ethyl]-2-methyl-5-(3-methyl-1,2-oxazol-5-yl)benzenesulfonamide Openeye Name: 2-methyl-5-(3-methylisoxazol-5-yl)-N-[2-[sec-butyl(2-thienylmethyl)amino]ethyl]benzenesulfonamide CAS Name: N-[2-[butan-2-yl(thiophen-2-ylmethyl)amino]ethyl]-2-methyl-5-(3-methyl-5-isoxazolyl)benzenesulfonamide IUPAC Name: N-[2-[butan-2-yl(thiophen-2-ylmethyl)amino]ethyl]-2-methyl-5-(3-methyl-1,2-oxazol-5-yl)benzenesulfonamide Traditional Name: 2-methyl-5-(3-methylisoxazol-5-yl)-N-[2-[sec-butyl(2-thenyl)amino]ethyl]benzenesulfonamide Formula: C22H29N3O3S2 MolecularWeight: 447.61396

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N(CCNS(=O)(=O)C1=C(C=CC(=C1)C2=CC(=NO2)C)C)CC3=CC=CS3

Isomeric SMILES

CCC(C)N(CCNS(=O)(=O)C1=C(C=CC(=C1)C2=CC(=NO2)C)C)CC3=CC=CS3

InChI

InChI=1S/C22H29N3O3S2/c1-5-18(4)25(15-20-7-6-12-29-20)11-10-23-30(26,27)22-14-19(9-8-16(22)2)21-13-17(3)24-28-21/h6-9,12-14,18,23H,5,10-11,15H2,1-4H3