methyl 2-[2-(6-chloranylnaphthalen-2-yl)sulfonyl-1-(5-pyridin-4-ylpyrimidin-2-yl)piperazin-2-yl]ethanoate

Systemtic Name: methyl 2-[2-(6-chloranylnaphthalen-2-yl)sulfonyl-1-(5-pyridin-4-ylpyrimidin-2-yl)piperazin-2-yl]ethanoate Openeye Name: methyl 2-[2-[(6-chloro-2-naphthyl)sulfonyl]-1-[5-(4-pyridyl)pyrimidin-2-yl]piperazin-2-yl]acetate CAS Name: 2-[2-[(6-chloro-2-naphthalenyl)sulfonyl]-1-(5-pyridin-4-yl-2-pyrimidinyl)-2-piperazinyl]acetic acid methyl ester IUPAC Name: methyl 2-[2-(6-chloronaphthalen-2-yl)sulfonyl-1-(5-pyridin-4-ylpyrimidin-2-yl)piperazin-2-yl]acetate Traditional Name: 2-[2-[(6-chloro-2-naphthyl)sulfonyl]-1-[5-(4-pyridyl)pyrimidin-2-yl]piperazin-2-yl]acetic acid methyl ester Formula: C26H24ClN5O4S MolecularWeight: 538.01786

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1(CNCCN1C2=NC=C(C=N2)C3=CC=NC=C3)S(=O)(=O)C4=CC5=C(C=C4)C=C(C=C5)Cl

Isomeric SMILES

COC(=O)CC1(CNCCN1C2=NC=C(C=N2)C3=CC=NC=C3)S(=O)(=O)C4=CC5=C(C=C4)C=C(C=C5)Cl

InChI

InChI=1S/C26H24ClN5O4S/c1-36-24(33)14-26(37(34,35)23-5-3-19-12-22(27)4-2-20(19)13-23)17-29-10-11-32(26)25-30-15-21(16-31-25)18-6-8-28-9-7-18/h2-9,12-13,15-16,29H,10-11,14,17H2,1H3