(5-chloranyl-2-methylsulfanyl-pyrimidin-4-yl)-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)methanone

Systemtic Name: (5-chloranyl-2-methylsulfanyl-pyrimidin-4-yl)-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)methanone Openeye Name: (5-chloro-2-methylsulfanyl-pyrimidin-4-yl)-[4-(2-naphthylsulfonyl)piperazin-1-yl]methanone CAS Name: [5-chloro-2-(methylthio)-4-pyrimidinyl]-[4-(2-naphthalenylsulfonyl)-1-piperazinyl]methanone IUPAC Name: (5-chloro-2-methylsulfanylpyrimidin-4-yl)-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)methanone Traditional Name: [5-chloro-2-(methylthio)pyrimidin-4-yl]-[4-(2-naphthylsulfonyl)piperazino]methanone Formula: C20H19ClN4O3S2 MolecularWeight: 462.97286

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C(C(=N1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3)Cl

Isomeric SMILES

CSC1=NC=C(C(=N1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3)Cl

InChI

InChI=1S/C20H19ClN4O3S2/c1-29-20-22-13-17(21)18(23-20)19(26)24-8-10-25(11-9-24)30(27,28)16-7-6-14-4-2-3-5-15(14)12-16/h2-7,12-13H,8-11H2,1H3