3-[2-[(3,4,5-trimethoxyphenyl)amino]pyrimidin-4-yl]-1H-benzimidazole-2-thione

Systemtic Name: 3-[2-[(3,4,5-trimethoxyphenyl)amino]pyrimidin-4-yl]-1H-benzimidazole-2-thione Openeye Name: 3-[2-(3,4,5-trimethoxyanilino)pyrimidin-4-yl]-1H-benzimidazole-2-thione CAS Name: 3-[2-(3,4,5-trimethoxyanilino)-4-pyrimidinyl]-1H-benzimidazole-2-thione IUPAC Name: 3-[2-(3,4,5-trimethoxyanilino)pyrimidin-4-yl]-1H-benzimidazole-2-thione Traditional Name: 3-[2-(3,4,5-trimethoxyanilino)pyrimidin-4-yl]-1H-benzimidazole-2-thione Formula: C20H19N5O3S MolecularWeight: 409.46156

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)NC2=NC=CC(=N2)N3C4=CC=CC=C4NC3=S

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)NC2=NC=CC(=N2)N3C4=CC=CC=C4NC3=S

InChI

InChI=1S/C20H19N5O3S/c1-26-15-10-12(11-16(27-2)18(15)28-3)22-19-21-9-8-17(24-19)25-14-7-5-4-6-13(14)23-20(25)29/h4-11H,1-3H3,(H,23,29)(H,21,22,24)