N-(1,3-benzodioxol-5-ylmethyl)-6-(4-phenylphenyl)thieno[3,2-d]pyrimidin-4-amine

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-6-(4-phenylphenyl)thieno[3,2-d]pyrimidin-4-amine Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-6-(4-phenylphenyl)thieno[3,2-d]pyrimidin-4-amine CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-6-(4-phenylphenyl)-4-thieno[3,2-d]pyrimidinamine IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-6-(4-phenylphenyl)thieno[3,2-d]pyrimidin-4-amine Traditional Name: [6-(4-phenylphenyl)thieno[3,2-d]pyrimidin-4-yl]-piperonyl-amine Formula: C26H19N3O2S MolecularWeight: 437.51296

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC3=NC=NC4=C3SC(=C4)C5=CC=C(C=C5)C6=CC=CC=C6

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC3=NC=NC4=C3SC(=C4)C5=CC=C(C=C5)C6=CC=CC=C6

InChI

InChI=1S/C26H19N3O2S/c1-2-4-18(5-3-1)19-7-9-20(10-8-19)24-13-21-25(32-24)26(29-15-28-21)27-14-17-6-11-22-23(12-17)31-16-30-22/h1-13,15H,14,16H2,(H,27,28,29)