N-(5-methyl-1,2-oxazol-3-yl)-2-[3-[(2-methylphenyl)methylsulfonyl]indol-1-yl]ethanamide

Systemtic Name: N-(5-methyl-1,2-oxazol-3-yl)-2-[3-[(2-methylphenyl)methylsulfonyl]indol-1-yl]ethanamide Openeye Name: N-(5-methylisoxazol-3-yl)-2-[3-(o-tolylmethylsulfonyl)indol-1-yl]acetamide CAS Name: N-(5-methyl-3-isoxazolyl)-2-[3-[(2-methylphenyl)methylsulfonyl]-1-indolyl]acetamide IUPAC Name: N-(5-methyl-1,2-oxazol-3-yl)-2-[3-[(2-methylphenyl)methylsulfonyl]indol-1-yl]acetamide Traditional Name: 2-[3-(2-methylbenzyl)sulfonylindol-1-yl]-N-(5-methylisoxazol-3-yl)acetamide Formula: C22H21N3O4S MolecularWeight: 423.48484

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CS(=O)(=O)C2=CN(C3=CC=CC=C32)CC(=O)NC4=NOC(=C4)C

Isomeric SMILES

CC1=CC=CC=C1CS(=O)(=O)C2=CN(C3=CC=CC=C32)CC(=O)NC4=NOC(=C4)C

InChI

InChI=1S/C22H21N3O4S/c1-15-7-3-4-8-17(15)14-30(27,28)20-12-25(19-10-6-5-9-18(19)20)13-22(26)23-21-11-16(2)29-24-21/h3-12H,13-14H2,1-2H3,(H,23,24,26)