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

Systemtic Name: 6-methyl-4-(phenethylamino)-5-phenyl-pyrrolo[3,2-d]pyrimidine-7-carbonitrile Openeye Name: 6-methyl-4-(phenethylamino)-5-phenyl-pyrrolo[3,2-d]pyrimidine-7-carbonitrile CAS Name: 6-methyl-4-(phenethylamino)-5-phenyl-7-pyrrolo[3,2-d]pyrimidinecarbonitrile IUPAC Name: 6-methyl-4-(phenethylamino)-5-phenylpyrrolo[3,2-d]pyrimidine-7-carbonitrile Traditional Name: 6-methyl-4-(phenethylamino)-5-phenyl-pyrrolo[3,2-d]pyrimidine-7-carbonitrile Formula: C22H19N5 MolecularWeight: 353.41976

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1C3=CC=CC=C3)C(=NC=N2)NCCC4=CC=CC=C4)C#N

Isomeric SMILES

CC1=C(C2=C(N1C3=CC=CC=C3)C(=NC=N2)NCCC4=CC=CC=C4)C#N

InChI

InChI=1S/C22H19N5/c1-16-19(14-23)20-21(27(16)18-10-6-3-7-11-18)22(26-15-25-20)24-13-12-17-8-4-2-5-9-17/h2-11,15H,12-13H2,1H3,(H,24,25,26)