[4-(6-chloranylnaphthalen-2-yl)sulfonyl-2-(hydroxymethyl)-3-methyl-piperazin-1-yl]-(4-pyridin-2-ylphenyl)methanone

Systemtic Name: [4-(6-chloranylnaphthalen-2-yl)sulfonyl-2-(hydroxymethyl)-3-methyl-piperazin-1-yl]-(4-pyridin-2-ylphenyl)methanone Openeye Name: [4-[(6-chloro-2-naphthyl)sulfonyl]-2-(hydroxymethyl)-3-methyl-piperazin-1-yl]-[4-(2-pyridyl)phenyl]methanone CAS Name: [4-[(6-chloro-2-naphthalenyl)sulfonyl]-2-(hydroxymethyl)-3-methyl-1-piperazinyl]-[4-(2-pyridinyl)phenyl]methanone IUPAC Name: [4-(6-chloronaphthalen-2-yl)sulfonyl-2-(hydroxymethyl)-3-methylpiperazin-1-yl]-(4-pyridin-2-ylphenyl)methanone Traditional Name: [4-[(6-chloro-2-naphthyl)sulfonyl]-3-methyl-2-methylol-piperazino]-[4-(2-pyridyl)phenyl]methanone Formula: C28H26ClN3O4S MolecularWeight: 536.04174

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(N(CCN1S(=O)(=O)C2=CC3=C(C=C2)C=C(C=C3)Cl)C(=O)C4=CC=C(C=C4)C5=CC=CC=N5)CO

Isomeric SMILES

CC1C(N(CCN1S(=O)(=O)C2=CC3=C(C=C2)C=C(C=C3)Cl)C(=O)C4=CC=C(C=C4)C5=CC=CC=N5)CO

InChI

InChI=1S/C28H26ClN3O4S/c1-19-27(18-33)31(28(34)21-7-5-20(6-8-21)26-4-2-3-13-30-26)14-15-32(19)37(35,36)25-12-10-22-16-24(29)11-9-23(22)17-25/h2-13,16-17,19,27,33H,14-15,18H2,1H3