1-phenyl-5-[(E)-thiophen-2-ylmethylideneamino]pyrazolo[3,4-d]pyrimidin-4-imine

Systemtic Name: 1-phenyl-5-[(E)-thiophen-2-ylmethylideneamino]pyrazolo[3,4-d]pyrimidin-4-imine Openeye Name: 1-phenyl-5-[(E)-2-thienylmethyleneamino]pyrazolo[3,4-d]pyrimidin-4-imine CAS Name: 1-phenyl-5-[(E)-thiophen-2-ylmethylideneamino]-4-pyrazolo[3,4-d]pyrimidinimine IUPAC Name: 1-phenyl-5-[(E)-thiophen-2-ylmethylideneamino]pyrazolo[3,4-d]pyrimidin-4-imine Traditional Name: (E)-(4-imino-1-phenyl-pyrazolo[3,4-d]pyrimidin-5-yl)-(2-thenylidene)amine Formula: C16H12N6S MolecularWeight: 320.37168

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C3=C(C=N2)C(=N)N(C=N3)N=CC4=CC=CS4

Isomeric SMILES

C1=CC=C(C=C1)N2C3=C(C=N2)C(=N)N(C=N3)/N=C/C4=CC=CS4

InChI

InChI=1S/C16H12N6S/c17-15-14-10-20-22(12-5-2-1-3-6-12)16(14)18-11-21(15)19-9-13-7-4-8-23-13/h1-11,17H/b17-15?,19-9+