1-[6-methyl-1-(phenylmethyl)-4-propylsulfanyl-2-sulfanylidene-pyrimidin-5-yl]ethanone

Systemtic Name: 1-[6-methyl-1-(phenylmethyl)-4-propylsulfanyl-2-sulfanylidene-pyrimidin-5-yl]ethanone Openeye Name: 1-(1-benzyl-6-methyl-4-propylsulfanyl-2-thioxo-pyrimidin-5-yl)ethanone CAS Name: 1-[6-methyl-1-(phenylmethyl)-4-(propylthio)-2-sulfanylidene-5-pyrimidinyl]ethanone IUPAC Name: 1-(1-benzyl-6-methyl-4-propylsulfanyl-2-sulfanylidenepyrimidin-5-yl)ethanone Traditional Name: 1-[1-benzyl-6-methyl-4-(propylthio)-2-thioxo-pyrimidin-5-yl]ethanone Formula: C17H20N2OS2 MolecularWeight: 332.4835

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NC(=S)N(C(=C1C(=O)C)C)CC2=CC=CC=C2

Isomeric SMILES

CCCSC1=NC(=S)N(C(=C1C(=O)C)C)CC2=CC=CC=C2

InChI

InChI=1S/C17H20N2OS2/c1-4-10-22-16-15(13(3)20)12(2)19(17(21)18-16)11-14-8-6-5-7-9-14/h5-9H,4,10-11H2,1-3H3