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

Systemtic Name: 4,6-bis(azanyl)-7-[(E)-4-phenylbut-2-enyl]pyrrolo[2,3-d]pyrimidine-5-carbonitrile Openeye Name: 4,6-diamino-7-[(E)-4-phenylbut-2-enyl]pyrrolo[2,3-d]pyrimidine-5-carbonitrile CAS Name: 4,6-diamino-7-[(E)-4-phenylbut-2-enyl]-5-pyrrolo[2,3-d]pyrimidinecarbonitrile IUPAC Name: 4,6-diamino-7-[(E)-4-phenylbut-2-enyl]pyrrolo[2,3-d]pyrimidine-5-carbonitrile Traditional Name: 4,6-diamino-7-[(E)-4-phenylbut-2-enyl]pyrrolo[2,3-d]pyrimidine-5-carbonitrile Formula: C17H16N6 MolecularWeight: 304.34914

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC=CCN2C(=C(C3=C2N=CN=C3N)C#N)N

Isomeric SMILES

C1=CC=C(C=C1)C/C=C/CN2C(=C(C3=C2N=CN=C3N)C#N)N

InChI

InChI=1S/C17H16N6/c18-10-13-14-15(19)21-11-22-17(14)23(16(13)20)9-5-4-8-12-6-2-1-3-7-12/h1-7,11H,8-9,20H2,(H2,19,21,22)/b5-4+