2-[(4-methoxyphenyl)methyl]-5-[1-(phenylsulfonyl)piperidin-4-yl]-1,3,4-thiadiazole

Systemtic Name: 2-[(4-methoxyphenyl)methyl]-5-[1-(phenylsulfonyl)piperidin-4-yl]-1,3,4-thiadiazole Openeye Name: 2-[1-(benzenesulfonyl)-4-piperidyl]-5-[(4-methoxyphenyl)methyl]-1,3,4-thiadiazole CAS Name: 2-[1-(benzenesulfonyl)-4-piperidinyl]-5-[(4-methoxyphenyl)methyl]-1,3,4-thiadiazole IUPAC Name: 2-[1-(benzenesulfonyl)piperidin-4-yl]-5-[(4-methoxyphenyl)methyl]-1,3,4-thiadiazole Traditional Name: 2-(1-besyl-4-piperidyl)-5-p-anisyl-1,3,4-thiadiazole Formula: C21H23N3O3S2 MolecularWeight: 429.55562

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC2=NN=C(S2)C3CCN(CC3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)CC2=NN=C(S2)C3CCN(CC3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C21H23N3O3S2/c1-27-18-9-7-16(8-10-18)15-20-22-23-21(28-20)17-11-13-24(14-12-17)29(25,26)19-5-3-2-4-6-19/h2-10,17H,11-15H2,1H3