2-[1-(phenylmethyl)imidazol-2-yl]sulfanyl-1-(4-thiophen-2-ylcarbonylpiperazin-1-yl)ethanone

Systemtic Name: 2-[1-(phenylmethyl)imidazol-2-yl]sulfanyl-1-(4-thiophen-2-ylcarbonylpiperazin-1-yl)ethanone Openeye Name: 2-(1-benzylimidazol-2-yl)sulfanyl-1-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethanone CAS Name: 1-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]-2-[[1-(phenylmethyl)-2-imidazolyl]thio]ethanone IUPAC Name: 2-(1-benzylimidazol-2-yl)sulfanyl-1-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethanone Traditional Name: 2-[(1-benzylimidazol-2-yl)thio]-1-[4-(2-thenoyl)piperazino]ethanone Formula: C21H22N4O2S2 MolecularWeight: 426.55498

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CSC2=NC=CN2CC3=CC=CC=C3)C(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CCN1C(=O)CSC2=NC=CN2CC3=CC=CC=C3)C(=O)C4=CC=CS4

InChI

InChI=1S/C21H22N4O2S2/c26-19(23-10-12-24(13-11-23)20(27)18-7-4-14-28-18)16-29-21-22-8-9-25(21)15-17-5-2-1-3-6-17/h1-9,14H,10-13,15-16H2