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

Systemtic Name: 1-[2-methyl-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)-2-methyl-piperazin-1-yl]butan-1-one CAS Name: 1-[2-methyl-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)-2-methylpiperazin-1-yl]butan-1-one Traditional Name: 1-[4-(3-benzyl-1,2,4-thiadiazol-5-yl)-2-methyl-piperazino]butan-1-one Formula: C18H24N4OS MolecularWeight: 344.47436

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N1CCN(CC1C)C2=NC(=NS2)CC3=CC=CC=C3

Isomeric SMILES

CCCC(=O)N1CCN(CC1C)C2=NC(=NS2)CC3=CC=CC=C3

InChI

InChI=1S/C18H24N4OS/c1-3-7-17(23)22-11-10-21(13-14(22)2)18-19-16(20-24-18)12-15-8-5-4-6-9-15/h4-6,8-9,14H,3,7,10-13H2,1-2H3