1-[4-(3-methylsulfonyl-1,2,4-thiadiazol-5-yl)piperazin-1-yl]-3-phenyl-prop-2-yn-1-one

Systemtic Name: 1-[4-(3-methylsulfonyl-1,2,4-thiadiazol-5-yl)piperazin-1-yl]-3-phenyl-prop-2-yn-1-one Openeye Name: 1-[4-(3-methylsulfonyl-1,2,4-thiadiazol-5-yl)piperazin-1-yl]-3-phenyl-prop-2-yn-1-one CAS Name: 1-[4-(3-methylsulfonyl-1,2,4-thiadiazol-5-yl)-1-piperazinyl]-3-phenyl-2-propyn-1-one IUPAC Name: 1-[4-(3-methylsulfonyl-1,2,4-thiadiazol-5-yl)piperazin-1-yl]-3-phenylprop-2-yn-1-one Traditional Name: 1-[4-(3-mesyl-1,2,4-thiadiazol-5-yl)piperazino]-3-phenyl-prop-2-yn-1-one Formula: C16H16N4O3S2 MolecularWeight: 376.45324

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=NSC(=N1)N2CCN(CC2)C(=O)C#CC3=CC=CC=C3

Isomeric SMILES

CS(=O)(=O)C1=NSC(=N1)N2CCN(CC2)C(=O)C#CC3=CC=CC=C3

InChI

InChI=1S/C16H16N4O3S2/c1-25(22,23)15-17-16(24-18-15)20-11-9-19(10-12-20)14(21)8-7-13-5-3-2-4-6-13/h2-6H,9-12H2,1H3