N-[2-(1,3-benzothiazol-6-ylmethyl)-6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]-1,2,4-oxadiazol-3-amine

Systemtic Name: N-[2-(1,3-benzothiazol-6-ylmethyl)-6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]-1,2,4-oxadiazol-3-amine Openeye Name: N-[2-(1,3-benzothiazol-6-ylmethyl)-6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]-1,2,4-oxadiazol-3-amine CAS Name: N-[2-(1,3-benzothiazol-6-ylmethyl)-6-(4-methyl-1-piperazinyl)-4-pyrimidinyl]-1,2,4-oxadiazol-3-amine IUPAC Name: N-[2-(1,3-benzothiazol-6-ylmethyl)-6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]-1,2,4-oxadiazol-3-amine Traditional Name: [2-(1,3-benzothiazol-6-ylmethyl)-6-(4-methylpiperazino)pyrimidin-4-yl]-(1,2,4-oxadiazol-3-yl)amine Formula: C19H20N8OS MolecularWeight: 408.4801

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CC(=NC(=N2)CC3=CC4=C(C=C3)N=CS4)NC5=NOC=N5

Isomeric SMILES

CN1CCN(CC1)C2=CC(=NC(=N2)CC3=CC4=C(C=C3)N=CS4)NC5=NOC=N5

InChI

InChI=1S/C19H20N8OS/c1-26-4-6-27(7-5-26)18-10-17(24-19-20-11-28-25-19)22-16(23-18)9-13-2-3-14-15(8-13)29-12-21-14/h2-3,8,10-12H,4-7,9H2,1H3,(H,22,23,24,25)