2-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl-methyl-amino]-N-(3-pyrrolidin-1-ylsulfonylphenyl)ethanamide

Systemtic Name: 2-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl-methyl-amino]-N-(3-pyrrolidin-1-ylsulfonylphenyl)ethanamide Openeye Name: 2-[(3,5-dimethylisoxazol-4-yl)sulfonyl-methyl-amino]-N-(3-pyrrolidin-1-ylsulfonylphenyl)acetamide CAS Name: 2-[(3,5-dimethyl-4-isoxazolyl)sulfonyl-methylamino]-N-[3-(1-pyrrolidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl-methylamino]-N-(3-pyrrolidin-1-ylsulfonylphenyl)acetamide Traditional Name: 2-[(3,5-dimethylisoxazol-4-yl)sulfonyl-methyl-amino]-N-(3-pyrrolidinosulfonylphenyl)acetamide Formula: C18H24N4O6S2 MolecularWeight: 456.53636

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)S(=O)(=O)N(C)CC(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

CC1=C(C(=NO1)C)S(=O)(=O)N(C)CC(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C18H24N4O6S2/c1-13-18(14(2)28-20-13)30(26,27)21(3)12-17(23)19-15-7-6-8-16(11-15)29(24,25)22-9-4-5-10-22/h6-8,11H,4-5,9-10,12H2,1-3H3,(H,19,23)