N-(1,3-benzodioxol-5-ylmethyl)-2-imidazol-1-yl-5-thiophen-2-yl-pyrimidin-4-amine

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-imidazol-1-yl-5-thiophen-2-yl-pyrimidin-4-amine Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-imidazol-1-yl-5-(2-thienyl)pyrimidin-4-amine CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(1-imidazolyl)-5-thiophen-2-yl-4-pyrimidinamine IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-imidazol-1-yl-5-thiophen-2-ylpyrimidin-4-amine Traditional Name: [2-imidazol-1-yl-5-(2-thienyl)pyrimidin-4-yl]-piperonyl-amine Formula: C19H15N5O2S MolecularWeight: 377.4197

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC3=NC(=NC=C3C4=CC=CS4)N5C=CN=C5

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC3=NC(=NC=C3C4=CC=CS4)N5C=CN=C5

InChI

InChI=1S/C19H15N5O2S/c1-2-17(27-7-1)14-10-22-19(24-6-5-20-11-24)23-18(14)21-9-13-3-4-15-16(8-13)26-12-25-15/h1-8,10-11H,9,12H2,(H,21,22,23)