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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H22N4OS/c1-3-16(22)21-10-9-20(12-13(21)2)17-18-15(19-23-17)11-14-7-5-4-6-8-14/h4-8,13H,3,9-12H2,1-2H3