4-(3-methoxyphenyl)-5-(2-methylphenyl)pyrrolo[3,2-d]pyrimidine-7-carbonitrile

Systemtic Name: 4-(3-methoxyphenyl)-5-(2-methylphenyl)pyrrolo[3,2-d]pyrimidine-7-carbonitrile Openeye Name: 4-(3-methoxyphenyl)-5-(o-tolyl)pyrrolo[3,2-d]pyrimidine-7-carbonitrile CAS Name: 4-(3-methoxyphenyl)-5-(2-methylphenyl)-7-pyrrolo[3,2-d]pyrimidinecarbonitrile IUPAC Name: 4-(3-methoxyphenyl)-5-(2-methylphenyl)pyrrolo[3,2-d]pyrimidine-7-carbonitrile Traditional Name: 4-(3-methoxyphenyl)-5-(o-tolyl)pyrrolo[3,2-d]pyrimidine-7-carbonitrile Formula: C21H16N4O MolecularWeight: 340.37794

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C=C(C3=C2C(=NC=N3)C4=CC(=CC=C4)OC)C#N

Isomeric SMILES

CC1=CC=CC=C1N2C=C(C3=C2C(=NC=N3)C4=CC(=CC=C4)OC)C#N

InChI

InChI=1S/C21H16N4O/c1-14-6-3-4-9-18(14)25-12-16(11-22)20-21(25)19(23-13-24-20)15-7-5-8-17(10-15)26-2/h3-10,12-13H,1-2H3