1-[3-[5-(phenylmethyl)-1,3,4-thiadiazol-2-yl]piperidin-1-yl]butan-1-one

Systemtic Name: 1-[3-[5-(phenylmethyl)-1,3,4-thiadiazol-2-yl]piperidin-1-yl]butan-1-one Openeye Name: 1-[3-(5-benzyl-1,3,4-thiadiazol-2-yl)-1-piperidyl]butan-1-one CAS Name: 1-[3-[5-(phenylmethyl)-1,3,4-thiadiazol-2-yl]-1-piperidinyl]-1-butanone IUPAC Name: 1-[3-(5-benzyl-1,3,4-thiadiazol-2-yl)piperidin-1-yl]butan-1-one Traditional Name: 1-[3-(5-benzyl-1,3,4-thiadiazol-2-yl)piperidino]butan-1-one Formula: C18H23N3OS MolecularWeight: 329.45972

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N1CCCC(C1)C2=NN=C(S2)CC3=CC=CC=C3

Isomeric SMILES

CCCC(=O)N1CCCC(C1)C2=NN=C(S2)CC3=CC=CC=C3

InChI

InChI=1S/C18H23N3OS/c1-2-7-17(22)21-11-6-10-15(13-21)18-20-19-16(23-18)12-14-8-4-3-5-9-14/h3-5,8-9,15H,2,6-7,10-13H2,1H3