methyl 1-[3-(6-chloranylnaphthalen-2-yl)sulfonylpropanoyl]-4-(2-methylpyridin-4-yl)piperazine-2-carboxylate

Systemtic Name: methyl 1-[3-(6-chloranylnaphthalen-2-yl)sulfonylpropanoyl]-4-(2-methylpyridin-4-yl)piperazine-2-carboxylate Openeye Name: methyl 1-[3-[(6-chloro-2-naphthyl)sulfonyl]propanoyl]-4-(2-methyl-4-pyridyl)piperazine-2-carboxylate CAS Name: 1-[3-[(6-chloro-2-naphthalenyl)sulfonyl]-1-oxopropyl]-4-(2-methyl-4-pyridinyl)-2-piperazinecarboxylic acid methyl ester IUPAC Name: methyl 1-[3-(6-chloronaphthalen-2-yl)sulfonylpropanoyl]-4-(2-methylpyridin-4-yl)piperazine-2-carboxylate Traditional Name: 1-[3-[(6-chloro-2-naphthyl)sulfonyl]propanoyl]-4-(2-methyl-4-pyridyl)piperazine-2-carboxylic acid methyl ester Formula: C25H26ClN3O5S MolecularWeight: 516.00904

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=CC(=C1)N2CCN(C(C2)C(=O)OC)C(=O)CCS(=O)(=O)C3=CC4=C(C=C3)C=C(C=C4)Cl

Isomeric SMILES

CC1=NC=CC(=C1)N2CCN(C(C2)C(=O)OC)C(=O)CCS(=O)(=O)C3=CC4=C(C=C3)C=C(C=C4)Cl

InChI

InChI=1S/C25H26ClN3O5S/c1-17-13-21(7-9-27-17)28-10-11-29(23(16-28)25(31)34-2)24(30)8-12-35(32,33)22-6-4-18-14-20(26)5-3-19(18)15-22/h3-7,9,13-15,23H,8,10-12,16H2,1-2H3