N-[3-(4-azanylpyrazolo[3,4-d]pyrimidin-1-yl)phenyl]thiophene-3-carboxamide

Systemtic Name: N-[3-(4-azanylpyrazolo[3,4-d]pyrimidin-1-yl)phenyl]thiophene-3-carboxamide Openeye Name: N-[3-(4-aminopyrazolo[3,4-d]pyrimidin-1-yl)phenyl]thiophene-3-carboxamide CAS Name: N-[3-(4-amino-1-pyrazolo[3,4-d]pyrimidinyl)phenyl]-3-thiophenecarboxamide IUPAC Name: N-[3-(4-aminopyrazolo[3,4-d]pyrimidin-1-yl)phenyl]thiophene-3-carboxamide Traditional Name: N-[3-(4-aminopyrazolo[3,4-d]pyrimidin-1-yl)phenyl]thiophene-3-carboxamide Formula: C16H12N6OS MolecularWeight: 336.37108

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)C2=CSC=C2)N3C4=C(C=N3)C(=NC=N4)N

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)C2=CSC=C2)N3C4=C(C=N3)C(=NC=N4)N

InChI

InChI=1S/C16H12N6OS/c17-14-13-7-20-22(15(13)19-9-18-14)12-3-1-2-11(6-12)21-16(23)10-4-5-24-8-10/h1-9H,(H,21,23)(H2,17,18,19)