4,6-bis(azanyl)-7-(3-phenylpropyl)pyrrolo[2,3-d]pyrimidine-5-carbonitrile

Systemtic Name: 4,6-bis(azanyl)-7-(3-phenylpropyl)pyrrolo[2,3-d]pyrimidine-5-carbonitrile Openeye Name: 4,6-diamino-7-(3-phenylpropyl)pyrrolo[2,3-d]pyrimidine-5-carbonitrile CAS Name: 4,6-diamino-7-(3-phenylpropyl)-5-pyrrolo[2,3-d]pyrimidinecarbonitrile IUPAC Name: 4,6-diamino-7-(3-phenylpropyl)pyrrolo[2,3-d]pyrimidine-5-carbonitrile Traditional Name: 4,6-diamino-7-(3-phenylpropyl)pyrrolo[2,3-d]pyrimidine-5-carbonitrile Formula: C16H16N6 MolecularWeight: 292.33844

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCN2C(=C(C3=C2N=CN=C3N)C#N)N

Isomeric SMILES

C1=CC=C(C=C1)CCCN2C(=C(C3=C2N=CN=C3N)C#N)N

InChI

InChI=1S/C16H16N6/c17-9-12-13-14(18)20-10-21-16(13)22(15(12)19)8-4-7-11-5-2-1-3-6-11/h1-3,5-6,10H,4,7-8,19H2,(H2,18,20,21)