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

Systemtic Name: 1-[4-[3-(phenylmethyl)-1,2,4-thiadiazol-5-yl]piperazin-1-yl]butan-1-one Openeye Name: 1-[4-(3-benzyl-1,2,4-thiadiazol-5-yl)piperazin-1-yl]butan-1-one CAS Name: 1-[4-[3-(phenylmethyl)-1,2,4-thiadiazol-5-yl]-1-piperazinyl]-1-butanone IUPAC Name: 1-[4-(3-benzyl-1,2,4-thiadiazol-5-yl)piperazin-1-yl]butan-1-one Traditional Name: 1-[4-(3-benzyl-1,2,4-thiadiazol-5-yl)piperazino]butan-1-one Formula: C17H22N4OS MolecularWeight: 330.44778

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N1CCN(CC1)C2=NC(=NS2)CC3=CC=CC=C3

Isomeric SMILES

CCCC(=O)N1CCN(CC1)C2=NC(=NS2)CC3=CC=CC=C3

InChI

InChI=1S/C17H22N4OS/c1-2-6-16(22)20-9-11-21(12-10-20)17-18-15(19-23-17)13-14-7-4-3-5-8-14/h3-5,7-8H,2,6,9-13H2,1H3