6-[(5-azanyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-2-(4-methylpiperazin-1-yl)-1H-pyrimidin-4-one

Systemtic Name: 6-[(5-azanyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-2-(4-methylpiperazin-1-yl)-1H-pyrimidin-4-one Openeye Name: 6-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-2-(4-methylpiperazin-1-yl)-1H-pyrimidin-4-one CAS Name: 6-[[(5-amino-1,3,4-thiadiazol-2-yl)thio]methyl]-2-(4-methyl-1-piperazinyl)-1H-pyrimidin-4-one IUPAC Name: 6-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-2-(4-methylpiperazin-1-yl)-1H-pyrimidin-4-one Traditional Name: 6-[[(5-amino-1,3,4-thiadiazol-2-yl)thio]methyl]-2-(4-methylpiperazino)-1H-pyrimidin-4-one Formula: C12H17N7OS2 MolecularWeight: 339.43968

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=NC(=O)C=C(N2)CSC3=NN=C(S3)N

Isomeric SMILES

CN1CCN(CC1)C2=NC(=O)C=C(N2)CSC3=NN=C(S3)N

InChI

InChI=1S/C12H17N7OS2/c1-18-2-4-19(5-3-18)11-14-8(6-9(20)15-11)7-21-12-17-16-10(13)22-12/h6H,2-5,7H2,1H3,(H2,13,16)(H,14,15,20)