[4-[2-(4-chloranylphenoxy)ethyl]piperazin-1-yl]-(5-thiophen-2-yl-1H-pyrazol-3-yl)methanone

Systemtic Name: [4-[2-(4-chloranylphenoxy)ethyl]piperazin-1-yl]-(5-thiophen-2-yl-1H-pyrazol-3-yl)methanone Openeye Name: [4-[2-(4-chlorophenoxy)ethyl]piperazin-1-yl]-[5-(2-thienyl)-1H-pyrazol-3-yl]methanone CAS Name: [4-[2-(4-chlorophenoxy)ethyl]-1-piperazinyl]-(5-thiophen-2-yl-1H-pyrazol-3-yl)methanone IUPAC Name: [4-[2-(4-chlorophenoxy)ethyl]piperazin-1-yl]-(5-thiophen-2-yl-1H-pyrazol-3-yl)methanone Traditional Name: [4-[2-(4-chlorophenoxy)ethyl]piperazino]-[5-(2-thienyl)-1H-pyrazol-3-yl]methanone Formula: C20H21ClN4O2S MolecularWeight: 416.92434

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCOC2=CC=C(C=C2)Cl)C(=O)C3=NNC(=C3)C4=CC=CS4

Isomeric SMILES

C1CN(CCN1CCOC2=CC=C(C=C2)Cl)C(=O)C3=NNC(=C3)C4=CC=CS4

InChI

InChI=1S/C20H21ClN4O2S/c21-15-3-5-16(6-4-15)27-12-11-24-7-9-25(10-8-24)20(26)18-14-17(22-23-18)19-2-1-13-28-19/h1-6,13-14H,7-12H2,(H,22,23)