[3-[(4-chlorophenyl)sulfanylmethyl]-1-benzofuran-2-yl]-(4-phenylpiperazin-1-yl)methanone

Systemtic Name: [3-[(4-chlorophenyl)sulfanylmethyl]-1-benzofuran-2-yl]-(4-phenylpiperazin-1-yl)methanone Openeye Name: [3-[(4-chlorophenyl)sulfanylmethyl]benzofuran-2-yl]-(4-phenylpiperazin-1-yl)methanone CAS Name: [3-[[(4-chlorophenyl)thio]methyl]-2-benzofuranyl]-(4-phenyl-1-piperazinyl)methanone IUPAC Name: [3-[(4-chlorophenyl)sulfanylmethyl]-1-benzofuran-2-yl]-(4-phenylpiperazin-1-yl)methanone Traditional Name: [3-[[(4-chlorophenyl)thio]methyl]benzofuran-2-yl]-(4-phenylpiperazino)methanone Formula: C26H23ClN2O2S MolecularWeight: 462.99102

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C(=O)C3=C(C4=CC=CC=C4O3)CSC5=CC=C(C=C5)Cl

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C(=O)C3=C(C4=CC=CC=C4O3)CSC5=CC=C(C=C5)Cl

InChI

InChI=1S/C26H23ClN2O2S/c27-19-10-12-21(13-11-19)32-18-23-22-8-4-5-9-24(22)31-25(23)26(30)29-16-14-28(15-17-29)20-6-2-1-3-7-20/h1-13H,14-18H2