1,3-benzodioxol-5-yl-[3-[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl]piperidin-1-yl]methanone

Systemtic Name: 1,3-benzodioxol-5-yl-[3-[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl]piperidin-1-yl]methanone Openeye Name: 1,3-benzodioxol-5-yl-[3-[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl]-1-piperidyl]methanone CAS Name: 1,3-benzodioxol-5-yl-[3-[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl]-1-piperidinyl]methanone IUPAC Name: 1,3-benzodioxol-5-yl-[3-[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl]piperidin-1-yl]methanone Traditional Name: 1,3-benzodioxol-5-yl-[3-[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl]piperidino]methanone Formula: C22H21N3O4S MolecularWeight: 423.48484

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN=C(S2)C3CCCN(C3)C(=O)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN=C(S2)C3CCCN(C3)C(=O)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C22H21N3O4S/c1-27-17-7-4-14(5-8-17)20-23-24-21(30-20)16-3-2-10-25(12-16)22(26)15-6-9-18-19(11-15)29-13-28-18/h4-9,11,16H,2-3,10,12-13H2,1H3