6-[[4-(4-ethoxyphenyl)piperazin-1-yl]methyl]-7-phenyl-pyrrolo[2,3-d]pyrimidine-2-carbonitrile

Systemtic Name: 6-[[4-(4-ethoxyphenyl)piperazin-1-yl]methyl]-7-phenyl-pyrrolo[2,3-d]pyrimidine-2-carbonitrile Openeye Name: 6-[[4-(4-ethoxyphenyl)piperazin-1-yl]methyl]-7-phenyl-pyrrolo[2,3-d]pyrimidine-2-carbonitrile CAS Name: 6-[[4-(4-ethoxyphenyl)-1-piperazinyl]methyl]-7-phenyl-2-pyrrolo[2,3-d]pyrimidinecarbonitrile IUPAC Name: 6-[[4-(4-ethoxyphenyl)piperazin-1-yl]methyl]-7-phenylpyrrolo[2,3-d]pyrimidine-2-carbonitrile Traditional Name: 7-phenyl-6-[(4-p-phenetylpiperazino)methyl]pyrrolo[2,3-d]pyrimidine-2-carbonitrile Formula: C26H26N6O MolecularWeight: 438.52424

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2CCN(CC2)CC3=CC4=CN=C(N=C4N3C5=CC=CC=C5)C#N

Isomeric SMILES

CCOC1=CC=C(C=C1)N2CCN(CC2)CC3=CC4=CN=C(N=C4N3C5=CC=CC=C5)C#N

InChI

InChI=1S/C26H26N6O/c1-2-33-24-10-8-21(9-11-24)31-14-12-30(13-15-31)19-23-16-20-18-28-25(17-27)29-26(20)32(23)22-6-4-3-5-7-22/h3-11,16,18H,2,12-15,19H2,1H3