6-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylmethyl]phenanthridine

Systemtic Name: 6-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylmethyl]phenanthridine Openeye Name: 6-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylmethyl]phenanthridine CAS Name: 6-[[(1-phenyl-4-pyrazolo[3,4-d]pyrimidinyl)thio]methyl]phenanthridine IUPAC Name: 6-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylmethyl]phenanthridine Traditional Name: 6-[[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)thio]methyl]phenanthridine Formula: C25H17N5S MolecularWeight: 419.50098

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C3=C(C=N2)C(=NC=N3)SCC4=NC5=CC=CC=C5C6=CC=CC=C64

Isomeric SMILES

C1=CC=C(C=C1)N2C3=C(C=N2)C(=NC=N3)SCC4=NC5=CC=CC=C5C6=CC=CC=C64

InChI

InChI=1S/C25H17N5S/c1-2-8-17(9-3-1)30-24-21(14-28-30)25(27-16-26-24)31-15-23-20-12-5-4-10-18(20)19-11-6-7-13-22(19)29-23/h1-14,16H,15H2