2-[4-(hydroxymethyl)-1-(phenylmethyl)imidazol-2-yl]sulfanyl-1-(4-phenylpiperazin-1-yl)ethanone

Systemtic Name: 2-[4-(hydroxymethyl)-1-(phenylmethyl)imidazol-2-yl]sulfanyl-1-(4-phenylpiperazin-1-yl)ethanone Openeye Name: 2-[1-benzyl-4-(hydroxymethyl)imidazol-2-yl]sulfanyl-1-(4-phenylpiperazin-1-yl)ethanone CAS Name: 2-[[4-(hydroxymethyl)-1-(phenylmethyl)-2-imidazolyl]thio]-1-(4-phenyl-1-piperazinyl)ethanone IUPAC Name: 2-[1-benzyl-4-(hydroxymethyl)imidazol-2-yl]sulfanyl-1-(4-phenylpiperazin-1-yl)ethanone Traditional Name: 2-[(1-benzyl-4-methylol-imidazol-2-yl)thio]-1-(4-phenylpiperazino)ethanone Formula: C23H26N4O2S MolecularWeight: 422.54314

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C(=O)CSC3=NC(=CN3CC4=CC=CC=C4)CO

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C(=O)CSC3=NC(=CN3CC4=CC=CC=C4)CO

InChI

InChI=1S/C23H26N4O2S/c28-17-20-16-27(15-19-7-3-1-4-8-19)23(24-20)30-18-22(29)26-13-11-25(12-14-26)21-9-5-2-6-10-21/h1-10,16,28H,11-15,17-18H2