(2-ethylsulfanylphenyl)-[4-(5-morpholin-4-ylsulfonylpyridin-2-yl)piperazin-1-yl]methanone

Systemtic Name: (2-ethylsulfanylphenyl)-[4-(5-morpholin-4-ylsulfonylpyridin-2-yl)piperazin-1-yl]methanone Openeye Name: (2-ethylsulfanylphenyl)-[4-(5-morpholinosulfonyl-2-pyridyl)piperazin-1-yl]methanone CAS Name: [2-(ethylthio)phenyl]-[4-[5-(4-morpholinylsulfonyl)-2-pyridinyl]-1-piperazinyl]methanone IUPAC Name: (2-ethylsulfanylphenyl)-[4-(5-morpholin-4-ylsulfonylpyridin-2-yl)piperazin-1-yl]methanone Traditional Name: [2-(ethylthio)phenyl]-[4-(5-morpholinosulfonyl-2-pyridyl)piperazino]methanone Formula: C22H28N4O4S2 MolecularWeight: 476.61212

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC=CC=C1C(=O)N2CCN(CC2)C3=NC=C(C=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CCSC1=CC=CC=C1C(=O)N2CCN(CC2)C3=NC=C(C=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C22H28N4O4S2/c1-2-31-20-6-4-3-5-19(20)22(27)25-11-9-24(10-12-25)21-8-7-18(17-23-21)32(28,29)26-13-15-30-16-14-26/h3-8,17H,2,9-16H2,1H3