7-methyl-4-oxidanylidene-5-phenyl-3-(phenylmethyl)pyrrolo[3,2-d]pyrimidine-6-carbonitrile

Systemtic Name: 7-methyl-4-oxidanylidene-5-phenyl-3-(phenylmethyl)pyrrolo[3,2-d]pyrimidine-6-carbonitrile Openeye Name: 3-benzyl-7-methyl-4-oxo-5-phenyl-pyrrolo[3,2-d]pyrimidine-6-carbonitrile CAS Name: 7-methyl-4-oxo-5-phenyl-3-(phenylmethyl)-6-pyrrolo[3,2-d]pyrimidinecarbonitrile IUPAC Name: 3-benzyl-7-methyl-4-oxo-5-phenylpyrrolo[3,2-d]pyrimidine-6-carbonitrile Traditional Name: 3-benzyl-4-keto-7-methyl-5-phenyl-pyrrolo[3,2-d]pyrimidine-6-carbonitrile Formula: C21H16N4O MolecularWeight: 340.37794

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C2=C1N=CN(C2=O)CC3=CC=CC=C3)C4=CC=CC=C4)C#N

Isomeric SMILES

CC1=C(N(C2=C1N=CN(C2=O)CC3=CC=CC=C3)C4=CC=CC=C4)C#N

InChI

InChI=1S/C21H16N4O/c1-15-18(12-22)25(17-10-6-3-7-11-17)20-19(15)23-14-24(21(20)26)13-16-8-4-2-5-9-16/h2-11,14H,13H2,1H3