2-[(4-methoxyphenyl)methyl]-5-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]-1,3,4-thiadiazole

Systemtic Name: 2-[(4-methoxyphenyl)methyl]-5-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]-1,3,4-thiadiazole Openeye Name: 2-[(4-methoxyphenyl)methyl]-5-[1-(p-tolylsulfonyl)-4-piperidyl]-1,3,4-thiadiazole CAS Name: 2-[(4-methoxyphenyl)methyl]-5-[1-(4-methylphenyl)sulfonyl-4-piperidinyl]-1,3,4-thiadiazole IUPAC Name: 2-[(4-methoxyphenyl)methyl]-5-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]-1,3,4-thiadiazole Traditional Name: 2-p-anisyl-5-(1-tosyl-4-piperidyl)-1,3,4-thiadiazole Formula: C22H25N3O3S2 MolecularWeight: 443.5822

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C3=NN=C(S3)CC4=CC=C(C=C4)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C3=NN=C(S3)CC4=CC=C(C=C4)OC

InChI

InChI=1S/C22H25N3O3S2/c1-16-3-9-20(10-4-16)30(26,27)25-13-11-18(12-14-25)22-24-23-21(29-22)15-17-5-7-19(28-2)8-6-17/h3-10,18H,11-15H2,1-2H3