azanyl 2-[4-(5-chloranylpyridin-2-yl)piperazin-1-yl]sulfonyl-4-phenyl-butanoate

Systemtic Name: azanyl 2-[4-(5-chloranylpyridin-2-yl)piperazin-1-yl]sulfonyl-4-phenyl-butanoate Openeye Name: amino 2-[4-(5-chloro-2-pyridyl)piperazin-1-yl]sulfonyl-4-phenyl-butanoate CAS Name: 2-[[4-(5-chloro-2-pyridinyl)-1-piperazinyl]sulfonyl]-4-phenylbutanoic acid amino ester IUPAC Name: amino 2-[4-(5-chloropyridin-2-yl)piperazin-1-yl]sulfonyl-4-phenylbutanoate Traditional Name: 2-[4-(5-chloro-2-pyridyl)piperazino]sulfonyl-4-phenyl-butyric acid amino ester Formula: C19H23ClN4O4S MolecularWeight: 438.92832

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=C(C=C2)Cl)S(=O)(=O)C(CCC3=CC=CC=C3)C(=O)ON

Isomeric SMILES

C1CN(CCN1C2=NC=C(C=C2)Cl)S(=O)(=O)C(CCC3=CC=CC=C3)C(=O)ON

InChI

InChI=1S/C19H23ClN4O4S/c20-16-7-9-18(22-14-16)23-10-12-24(13-11-23)29(26,27)17(19(25)28-21)8-6-15-4-2-1-3-5-15/h1-5,7,9,14,17H,6,8,10-13,21H2