2-[4-(2-azanylethyl)piperazin-1-yl]-6-(ethylsulfanylmethyl)-1H-pyrimidin-4-one

Systemtic Name: 2-[4-(2-azanylethyl)piperazin-1-yl]-6-(ethylsulfanylmethyl)-1H-pyrimidin-4-one Openeye Name: 2-[4-(2-aminoethyl)piperazin-1-yl]-6-(ethylsulfanylmethyl)-1H-pyrimidin-4-one CAS Name: 2-[4-(2-aminoethyl)-1-piperazinyl]-6-[(ethylthio)methyl]-1H-pyrimidin-4-one IUPAC Name: 2-[4-(2-aminoethyl)piperazin-1-yl]-6-(ethylsulfanylmethyl)-1H-pyrimidin-4-one Traditional Name: 2-[4-(2-aminoethyl)piperazino]-6-[(ethylthio)methyl]-1H-pyrimidin-4-one Formula: C13H23N5OS MolecularWeight: 297.41962

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Descriptors Computed from Structure

Canonical SMILES:

CCSCC1=CC(=O)N=C(N1)N2CCN(CC2)CCN

Isomeric SMILES

CCSCC1=CC(=O)N=C(N1)N2CCN(CC2)CCN

InChI

InChI=1S/C13H23N5OS/c1-2-20-10-11-9-12(19)16-13(15-11)18-7-5-17(4-3-14)6-8-18/h9H,2-8,10,14H2,1H3,(H,15,16,19)