methyl 5-[5-(4-piperidin-4-ylphenyl)-1,3,4-thiadiazol-2-yl]pentanoate hydrochloride

Systemtic Name: methyl 5-[5-(4-piperidin-4-ylphenyl)-1,3,4-thiadiazol-2-yl]pentanoate hydrochloride Openeye Name: methyl 5-[5-[4-(4-piperidyl)phenyl]-1,3,4-thiadiazol-2-yl]pentanoate hydrochloride CAS Name: 5-[5-[4-(4-piperidinyl)phenyl]-1,3,4-thiadiazol-2-yl]pentanoic acid methyl ester hydrochloride IUPAC Name: methyl 5-[5-(4-piperidin-4-ylphenyl)-1,3,4-thiadiazol-2-yl]pentanoate hydrochloride Traditional Name: 5-[5-[4-(4-piperidyl)phenyl]-1,3,4-thiadiazol-2-yl]valeric acid methyl ester hydrochloride Formula: C19H26ClN3O2S MolecularWeight: 395.94664

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCC1=NN=C(S1)C2=CC=C(C=C2)C3CCNCC3.Cl

Isomeric SMILES

COC(=O)CCCCC1=NN=C(S1)C2=CC=C(C=C2)C3CCNCC3.Cl

InChI

InChI=1S/C19H25N3O2S.ClH/c1-24-18(23)5-3-2-4-17-21-22-19(25-17)16-8-6-14(7-9-16)15-10-12-20-13-11-15;/h6-9,15,20H,2-5,10-13H2,1H3;1H