7-(4-ethoxyphenyl)-4-[(3S)-3-methylpiperidin-1-yl]-5-phenyl-pyrrolo[2,3-d]pyrimidine

Systemtic Name: 7-(4-ethoxyphenyl)-4-[(3S)-3-methylpiperidin-1-yl]-5-phenyl-pyrrolo[2,3-d]pyrimidine Openeye Name: 7-(4-ethoxyphenyl)-4-[(3S)-3-methyl-1-piperidyl]-5-phenyl-pyrrolo[2,3-d]pyrimidine CAS Name: 7-(4-ethoxyphenyl)-4-[(3S)-3-methyl-1-piperidinyl]-5-phenylpyrrolo[2,3-d]pyrimidine IUPAC Name: 7-(4-ethoxyphenyl)-4-[(3S)-3-methylpiperidin-1-yl]-5-phenylpyrrolo[2,3-d]pyrimidine Traditional Name: 4-[(3S)-3-methylpiperidino]-5-phenyl-7-p-phenetyl-pyrrolo[2,3-d]pyrimidine Formula: C26H28N4O MolecularWeight: 412.52672

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C=C(C3=C2N=CN=C3N4CCCC(C4)C)C5=CC=CC=C5

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C=C(C3=C2N=CN=C3N4CCC[C@@H](C4)C)C5=CC=CC=C5

InChI

InChI=1S/C26H28N4O/c1-3-31-22-13-11-21(12-14-22)30-17-23(20-9-5-4-6-10-20)24-25(27-18-28-26(24)30)29-15-7-8-19(2)16-29/h4-6,9-14,17-19H,3,7-8,15-16H2,1-2H3/t19-/m0/s1