5-[4-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]sulfonylphenyl]-2-methyl-1,3-oxazole

Systemtic Name: 5-[4-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]sulfonylphenyl]-2-methyl-1,3-oxazole Openeye Name: 5-[4-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]sulfonylphenyl]-2-methyl-oxazole CAS Name: 5-[4-[[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]sulfonyl]phenyl]-2-methyloxazole IUPAC Name: 5-[4-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]sulfonylphenyl]-2-methyl-1,3-oxazole Traditional Name: 2-methyl-5-[4-(4-piperonylpiperazino)sulfonylphenyl]oxazole Formula: C22H23N3O5S MolecularWeight: 441.50012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(O1)C2=CC=C(C=C2)S(=O)(=O)N3CCN(CC3)CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=NC=C(O1)C2=CC=C(C=C2)S(=O)(=O)N3CCN(CC3)CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C22H23N3O5S/c1-16-23-13-22(30-16)18-3-5-19(6-4-18)31(26,27)25-10-8-24(9-11-25)14-17-2-7-20-21(12-17)29-15-28-20/h2-7,12-13H,8-11,14-15H2,1H3