1,3-benzodioxol-5-yl-(5,6-dimethyl-7-phenyl-pyrrolo[2,3-d]pyrimidin-4-yl)methanone

Systemtic Name: 1,3-benzodioxol-5-yl-(5,6-dimethyl-7-phenyl-pyrrolo[2,3-d]pyrimidin-4-yl)methanone Openeye Name: 1,3-benzodioxol-5-yl-(5,6-dimethyl-7-phenyl-pyrrolo[2,3-d]pyrimidin-4-yl)methanone CAS Name: 1,3-benzodioxol-5-yl-(5,6-dimethyl-7-phenyl-4-pyrrolo[2,3-d]pyrimidinyl)methanone IUPAC Name: 1,3-benzodioxol-5-yl-(5,6-dimethyl-7-phenylpyrrolo[2,3-d]pyrimidin-4-yl)methanone Traditional Name: 1,3-benzodioxol-5-yl-(5,6-dimethyl-7-phenyl-pyrrolo[2,3-d]pyrimidin-4-yl)methanone Formula: C22H17N3O3 MolecularWeight: 371.38868

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C2=NC=NC(=C12)C(=O)C3=CC4=C(C=C3)OCO4)C5=CC=CC=C5)C

Isomeric SMILES

CC1=C(N(C2=NC=NC(=C12)C(=O)C3=CC4=C(C=C3)OCO4)C5=CC=CC=C5)C

InChI

InChI=1S/C22H17N3O3/c1-13-14(2)25(16-6-4-3-5-7-16)22-19(13)20(23-11-24-22)21(26)15-8-9-17-18(10-15)28-12-27-17/h3-11H,12H2,1-2H3