5-methyl-3-phenyl-N-(3-pyrrolidin-1-ylsulfonylphenyl)-1,2-oxazole-4-carboxamide

Systemtic Name: 5-methyl-3-phenyl-N-(3-pyrrolidin-1-ylsulfonylphenyl)-1,2-oxazole-4-carboxamide Openeye Name: 5-methyl-3-phenyl-N-(3-pyrrolidin-1-ylsulfonylphenyl)isoxazole-4-carboxamide CAS Name: 5-methyl-3-phenyl-N-[3-(1-pyrrolidinylsulfonyl)phenyl]-4-isoxazolecarboxamide IUPAC Name: 5-methyl-3-phenyl-N-(3-pyrrolidin-1-ylsulfonylphenyl)-1,2-oxazole-4-carboxamide Traditional Name: 5-methyl-3-phenyl-N-(3-pyrrolidinosulfonylphenyl)isoxazole-4-carboxamide Formula: C21H21N3O4S MolecularWeight: 411.47414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)NC3=CC(=CC=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)NC3=CC(=CC=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C21H21N3O4S/c1-15-19(20(23-28-15)16-8-3-2-4-9-16)21(25)22-17-10-7-11-18(14-17)29(26,27)24-12-5-6-13-24/h2-4,7-11,14H,5-6,12-13H2,1H3,(H,22,25)