N-[3-(4-methylphenyl)-1,2-oxazol-5-yl]-4-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[3-(4-methylphenyl)-1,2-oxazol-5-yl]-4-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-[3-(p-tolyl)isoxazol-5-yl]-4-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-[3-(4-methylphenyl)-5-isoxazolyl]-4-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-[3-(4-methylphenyl)-1,2-oxazol-5-yl]-4-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-[3-(p-tolyl)isoxazol-5-yl]-4-pyrrolidinosulfonyl-benzamide Formula: C21H21N3O4S MolecularWeight: 411.47414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NOC(=C2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

CC1=CC=C(C=C1)C2=NOC(=C2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C21H21N3O4S/c1-15-4-6-16(7-5-15)19-14-20(28-23-19)22-21(25)17-8-10-18(11-9-17)29(26,27)24-12-2-3-13-24/h4-11,14H,2-3,12-13H2,1H3,(H,22,25)