2-(1-butylsulfonylpiperidin-3-yl)-5-(4-methoxyphenyl)-1,3,4-thiadiazole

Systemtic Name: 2-(1-butylsulfonylpiperidin-3-yl)-5-(4-methoxyphenyl)-1,3,4-thiadiazole Openeye Name: 2-(1-butylsulfonyl-3-piperidyl)-5-(4-methoxyphenyl)-1,3,4-thiadiazole CAS Name: 2-(1-butylsulfonyl-3-piperidinyl)-5-(4-methoxyphenyl)-1,3,4-thiadiazole IUPAC Name: 2-(1-butylsulfonylpiperidin-3-yl)-5-(4-methoxyphenyl)-1,3,4-thiadiazole Traditional Name: 2-(1-butylsulfonyl-3-piperidyl)-5-(4-methoxyphenyl)-1,3,4-thiadiazole Formula: C18H25N3O3S2 MolecularWeight: 395.5394

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)N1CCCC(C1)C2=NN=C(S2)C3=CC=C(C=C3)OC

Isomeric SMILES

CCCCS(=O)(=O)N1CCCC(C1)C2=NN=C(S2)C3=CC=C(C=C3)OC

InChI

InChI=1S/C18H25N3O3S2/c1-3-4-12-26(22,23)21-11-5-6-15(13-21)18-20-19-17(25-18)14-7-9-16(24-2)10-8-14/h7-10,15H,3-6,11-13H2,1-2H3