4-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-phenyl-pyrrolo[3,2-d]pyrimidine-7-carbonitrile

Systemtic Name: 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-phenyl-pyrrolo[3,2-d]pyrimidine-7-carbonitrile Openeye Name: 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-phenyl-pyrrolo[3,2-d]pyrimidine-7-carbonitrile CAS Name: 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-phenyl-7-pyrrolo[3,2-d]pyrimidinecarbonitrile IUPAC Name: 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-phenylpyrrolo[3,2-d]pyrimidine-7-carbonitrile Traditional Name: 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-phenyl-pyrrolo[3,2-d]pyrimidine-7-carbonitrile Formula: C21H14N4O2 MolecularWeight: 354.36146

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)C3=NC=NC4=C3N(C=C4C#N)C5=CC=CC=C5

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)C3=NC=NC4=C3N(C=C4C#N)C5=CC=CC=C5

InChI

InChI=1S/C21H14N4O2/c22-11-15-12-25(16-4-2-1-3-5-16)21-19(23-13-24-20(15)21)14-6-7-17-18(10-14)27-9-8-26-17/h1-7,10,12-13H,8-9H2