N-[[(5S)-2-oxidanylidene-3-[6-(4-pyrazin-2-ylcarbothioylpiperazin-1-yl)pyridin-3-yl]-1,3-oxazolidin-5-yl]methyl]ethanamide

Systemtic Name: N-[[(5S)-2-oxidanylidene-3-[6-(4-pyrazin-2-ylcarbothioylpiperazin-1-yl)pyridin-3-yl]-1,3-oxazolidin-5-yl]methyl]ethanamide Openeye Name: N-[[(5S)-2-oxo-3-[6-[4-(pyrazine-2-carbothioyl)piperazin-1-yl]-3-pyridyl]oxazolidin-5-yl]methyl]acetamide CAS Name: N-[[(5S)-2-oxo-3-[6-[4-[2-pyrazinyl(sulfanylidene)methyl]-1-piperazinyl]-3-pyridinyl]-5-oxazolidinyl]methyl]acetamide IUPAC Name: N-[[(5S)-2-oxo-3-[6-[4-(pyrazine-2-carbothioyl)piperazin-1-yl]pyridin-3-yl]-1,3-oxazolidin-5-yl]methyl]acetamide Traditional Name: N-[[(5S)-2-keto-3-[6-[4-(pyrazine-2-carbothioyl)piperazino]-3-pyridyl]oxazolidin-5-yl]methyl]acetamide Formula: C20H23N7O3S MolecularWeight: 441.50672

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCC1CN(C(=O)O1)C2=CN=C(C=C2)N3CCN(CC3)C(=S)C4=NC=CN=C4

Isomeric SMILES

CC(=O)NC[C@H]1CN(C(=O)O1)C2=CN=C(C=C2)N3CCN(CC3)C(=S)C4=NC=CN=C4

InChI

InChI=1S/C20H23N7O3S/c1-14(28)23-11-16-13-27(20(29)30-16)15-2-3-18(24-10-15)25-6-8-26(9-7-25)19(31)17-12-21-4-5-22-17/h2-5,10,12,16H,6-9,11,13H2,1H3,(H,23,28)/t16-/m0/s1