N',N'-diethyl-N-[7-(4-methylphenyl)-5-phenyl-pyrrolo[2,3-d]pyrimidin-4-yl]ethane-1,2-diamine

Systemtic Name: N',N'-diethyl-N-[7-(4-methylphenyl)-5-phenyl-pyrrolo[2,3-d]pyrimidin-4-yl]ethane-1,2-diamine Openeye Name: N',N'-diethyl-N-[5-phenyl-7-(p-tolyl)pyrrolo[2,3-d]pyrimidin-4-yl]ethane-1,2-diamine CAS Name: N',N'-diethyl-N-[7-(4-methylphenyl)-5-phenyl-4-pyrrolo[2,3-d]pyrimidinyl]ethane-1,2-diamine IUPAC Name: N',N'-diethyl-N-[7-(4-methylphenyl)-5-phenylpyrrolo[2,3-d]pyrimidin-4-yl]ethane-1,2-diamine Traditional Name: diethyl-[2-[[5-phenyl-7-(p-tolyl)pyrrolo[2,3-d]pyrimidin-4-yl]amino]ethyl]amine Formula: C25H29N5 MolecularWeight: 399.53126

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC1=NC=NC2=C1C(=CN2C3=CC=C(C=C3)C)C4=CC=CC=C4

Isomeric SMILES

CCN(CC)CCNC1=NC=NC2=C1C(=CN2C3=CC=C(C=C3)C)C4=CC=CC=C4

InChI

InChI=1S/C25H29N5/c1-4-29(5-2)16-15-26-24-23-22(20-9-7-6-8-10-20)17-30(25(23)28-18-27-24)21-13-11-19(3)12-14-21/h6-14,17-18H,4-5,15-16H2,1-3H3,(H,26,27,28)