2-(5-morpholin-4-ylsulfonylpyridin-2-yl)sulfanyl-1-(4-phenylpiperazin-1-yl)ethanone

Systemtic Name: 2-(5-morpholin-4-ylsulfonylpyridin-2-yl)sulfanyl-1-(4-phenylpiperazin-1-yl)ethanone Openeye Name: 2-[(5-morpholinosulfonyl-2-pyridyl)sulfanyl]-1-(4-phenylpiperazin-1-yl)ethanone CAS Name: 2-[[5-(4-morpholinylsulfonyl)-2-pyridinyl]thio]-1-(4-phenyl-1-piperazinyl)ethanone IUPAC Name: 2-(5-morpholin-4-ylsulfonylpyridin-2-yl)sulfanyl-1-(4-phenylpiperazin-1-yl)ethanone Traditional Name: 2-[(5-morpholinosulfonyl-2-pyridyl)thio]-1-(4-phenylpiperazino)ethanone Formula: C21H26N4O4S2 MolecularWeight: 462.58554

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C(=O)CSC3=NC=C(C=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C(=O)CSC3=NC=C(C=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C21H26N4O4S2/c26-21(24-10-8-23(9-11-24)18-4-2-1-3-5-18)17-30-20-7-6-19(16-22-20)31(27,28)25-12-14-29-15-13-25/h1-7,16H,8-15,17H2