4-[4-[2-(3-chloranylphenoxy)propanoyl]piperazin-1-yl]sulfonyl-1-methyl-pyrrole-2-carboxamide

Systemtic Name: 4-[4-[2-(3-chloranylphenoxy)propanoyl]piperazin-1-yl]sulfonyl-1-methyl-pyrrole-2-carboxamide Openeye Name: 4-[4-[2-(3-chlorophenoxy)propanoyl]piperazin-1-yl]sulfonyl-1-methyl-pyrrole-2-carboxamide CAS Name: 4-[[4-[2-(3-chlorophenoxy)-1-oxopropyl]-1-piperazinyl]sulfonyl]-1-methyl-2-pyrrolecarboxamide IUPAC Name: 4-[4-[2-(3-chlorophenoxy)propanoyl]piperazin-1-yl]sulfonyl-1-methylpyrrole-2-carboxamide Traditional Name: 4-[4-[2-(3-chlorophenoxy)propanoyl]piperazino]sulfonyl-1-methyl-pyrrole-2-carboxamide Formula: C19H23ClN4O5S MolecularWeight: 454.92772

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)S(=O)(=O)C2=CN(C(=C2)C(=O)N)C)OC3=CC(=CC=C3)Cl

Isomeric SMILES

CC(C(=O)N1CCN(CC1)S(=O)(=O)C2=CN(C(=C2)C(=O)N)C)OC3=CC(=CC=C3)Cl

InChI

InChI=1S/C19H23ClN4O5S/c1-13(29-15-5-3-4-14(20)10-15)19(26)23-6-8-24(9-7-23)30(27,28)16-11-17(18(21)25)22(2)12-16/h3-5,10-13H,6-9H2,1-2H3,(H2,21,25)