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

Systemtic Name: 2-[1-(4-methoxyphenyl)sulfonylpiperidin-3-yl]-5-(2-methylpropyl)-1,3,4-thiadiazole Openeye Name: 2-isobutyl-5-[1-(4-methoxyphenyl)sulfonyl-3-piperidyl]-1,3,4-thiadiazole CAS Name: 2-[1-(4-methoxyphenyl)sulfonyl-3-piperidinyl]-5-(2-methylpropyl)-1,3,4-thiadiazole IUPAC Name: 2-[1-(4-methoxyphenyl)sulfonylpiperidin-3-yl]-5-(2-methylpropyl)-1,3,4-thiadiazole Traditional Name: 2-isobutyl-5-[1-(4-methoxyphenyl)sulfonyl-3-piperidyl]-1,3,4-thiadiazole Formula: C18H25N3O3S2 MolecularWeight: 395.5394

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=NN=C(S1)C2CCCN(C2)S(=O)(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CC(C)CC1=NN=C(S1)C2CCCN(C2)S(=O)(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C18H25N3O3S2/c1-13(2)11-17-19-20-18(25-17)14-5-4-10-21(12-14)26(22,23)16-8-6-15(24-3)7-9-16/h6-9,13-14H,4-5,10-12H2,1-3H3