4-(azepin-1-yl)-1-[(E)-2-phenylethenyl]pyrazolo[3,4-d]pyrimidine

Systemtic Name: 4-(azepin-1-yl)-1-[(E)-2-phenylethenyl]pyrazolo[3,4-d]pyrimidine Openeye Name: 4-(azepin-1-yl)-1-[(E)-styryl]pyrazolo[3,4-d]pyrimidine CAS Name: 4-(1-azepinyl)-1-[(E)-2-phenylethenyl]pyrazolo[3,4-d]pyrimidine IUPAC Name: 4-(azepin-1-yl)-1-[(E)-2-phenylethenyl]pyrazolo[3,4-d]pyrimidine Traditional Name: 4-(azepin-1-yl)-1-[(E)-styryl]pyrazolo[3,4-d]pyrimidine Formula: C19H15N5 MolecularWeight: 313.3559

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=CN(C=C1)C2=NC=NC3=C2C=NN3C=CC4=CC=CC=C4

Isomeric SMILES

C1=CC=CN(C=C1)C2=NC=NC3=C2C=NN3/C=C/C4=CC=CC=C4

InChI

InChI=1S/C19H15N5/c1-2-7-12-23(11-6-1)18-17-14-22-24(19(17)21-15-20-18)13-10-16-8-4-3-5-9-16/h1-15H/b13-10+