2-(phenylmethylsulfanyl)-1-[4-(5-thiophen-2-yl-6H-1,3,4-thiadiazin-2-yl)piperazin-1-yl]ethanone

Systemtic Name: 2-(phenylmethylsulfanyl)-1-[4-(5-thiophen-2-yl-6H-1,3,4-thiadiazin-2-yl)piperazin-1-yl]ethanone Openeye Name: 2-benzylsulfanyl-1-[4-[5-(2-thienyl)-6H-1,3,4-thiadiazin-2-yl]piperazin-1-yl]ethanone CAS Name: 2-(phenylmethylthio)-1-[4-(5-thiophen-2-yl-6H-1,3,4-thiadiazin-2-yl)-1-piperazinyl]ethanone IUPAC Name: 2-benzylsulfanyl-1-[4-(5-thiophen-2-yl-6H-1,3,4-thiadiazin-2-yl)piperazin-1-yl]ethanone Traditional Name: 2-(benzylthio)-1-[4-[5-(2-thienyl)-6H-1,3,4-thiadiazin-2-yl]piperazino]ethanone Formula: C20H22N4OS3 MolecularWeight: 430.60988

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NN=C(CS2)C3=CC=CS3)C(=O)CSCC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C2=NN=C(CS2)C3=CC=CS3)C(=O)CSCC4=CC=CC=C4

InChI

InChI=1S/C20H22N4OS3/c25-19(15-26-13-16-5-2-1-3-6-16)23-8-10-24(11-9-23)20-22-21-17(14-28-20)18-7-4-12-27-18/h1-7,12H,8-11,13-15H2