N-[1-[4-(4-methoxyphenyl)piperazin-1-yl]sulfonyl-4-pyridin-3-yl-but-3-yn-2-yl]-N-oxidanyl-methanamide

Systemtic Name: N-[1-[4-(4-methoxyphenyl)piperazin-1-yl]sulfonyl-4-pyridin-3-yl-but-3-yn-2-yl]-N-oxidanyl-methanamide Openeye Name: N-hydroxy-N-[1-[[4-(4-methoxyphenyl)piperazin-1-yl]sulfonylmethyl]-3-(3-pyridyl)prop-2-ynyl]formamide CAS Name: N-hydroxy-N-[1-[[4-(4-methoxyphenyl)-1-piperazinyl]sulfonyl]-4-(3-pyridinyl)but-3-yn-2-yl]formamide IUPAC Name: N-hydroxy-N-[1-[4-(4-methoxyphenyl)piperazin-1-yl]sulfonyl-4-pyridin-3-ylbut-3-yn-2-yl]formamide Traditional Name: N-hydroxy-N-[1-[[4-(4-methoxyphenyl)piperazino]sulfonylmethyl]-3-(3-pyridyl)prop-2-ynyl]formamide Formula: C21H24N4O5S MolecularWeight: 444.50406

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)S(=O)(=O)CC(C#CC3=CN=CC=C3)N(C=O)O

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)S(=O)(=O)CC(C#CC3=CN=CC=C3)N(C=O)O

InChI

InChI=1S/C21H24N4O5S/c1-30-21-8-6-19(7-9-21)23-11-13-24(14-12-23)31(28,29)16-20(25(27)17-26)5-4-18-3-2-10-22-15-18/h2-3,6-10,15,17,20,27H,11-14,16H2,1H3