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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)S(=O)(=O)N2CCCC(C2)C3=NN=C(S3)C4=CC=C(C=C4)OC

Isomeric SMILES

CCC1=CC=C(C=C1)S(=O)(=O)N2CCCC(C2)C3=NN=C(S3)C4=CC=C(C=C4)OC

InChI

InChI=1S/C22H25N3O3S2/c1-3-16-6-12-20(13-7-16)30(26,27)25-14-4-5-18(15-25)22-24-23-21(29-22)17-8-10-19(28-2)11-9-17/h6-13,18H,3-5,14-15H2,1-2H3