[4-(ethylsulfonylamino)piperidin-1-yl]-(2-sulfanylidenepyridin-3-ylidene)methanolate

Systemtic Name: [4-(ethylsulfonylamino)piperidin-1-yl]-(2-sulfanylidenepyridin-3-ylidene)methanolate Openeye Name: [4-(ethylsulfonylamino)-1-piperidyl]-(2-thioxo-3-pyridylidene)methanolate CAS Name: [4-(ethylsulfonylamino)-1-piperidinyl]-(2-sulfanylidene-3-pyridinylidene)methanolate IUPAC Name: [4-(ethylsulfonylamino)piperidin-1-yl]-(2-sulfanylidenepyridin-3-ylidene)methanolate Traditional Name: [4-(esylamino)piperidino]-(2-thioxo-3-pyridylidene)methanolate Formula: C13H18N3O3S2- MolecularWeight: 328.43032

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)NC1CCN(CC1)C(=C2C=CC=NC2=S)[O-]

Isomeric SMILES

CCS(=O)(=O)NC1CCN(CC1)C(=C2C=CC=NC2=S)[O-]

InChI

InChI=1S/C13H19N3O3S2/c1-2-21(18,19)15-10-5-8-16(9-6-10)13(17)11-4-3-7-14-12(11)20/h3-4,7,10,15,17H,2,5-6,8-9H2,1H3/p-1