7-(3-chloranyl-4-methyl-phenyl)-5-phenyl-N-(phenylmethyl)pyrrolo[2,3-d]pyrimidin-4-amine

Systemtic Name: 7-(3-chloranyl-4-methyl-phenyl)-5-phenyl-N-(phenylmethyl)pyrrolo[2,3-d]pyrimidin-4-amine Openeye Name: N-benzyl-7-(3-chloro-4-methyl-phenyl)-5-phenyl-pyrrolo[2,3-d]pyrimidin-4-amine CAS Name: 7-(3-chloro-4-methylphenyl)-5-phenyl-N-(phenylmethyl)-4-pyrrolo[2,3-d]pyrimidinamine IUPAC Name: N-benzyl-7-(3-chloro-4-methylphenyl)-5-phenylpyrrolo[2,3-d]pyrimidin-4-amine Traditional Name: benzyl-[7-(3-chloro-4-methyl-phenyl)-5-phenyl-pyrrolo[2,3-d]pyrimidin-4-yl]amine Formula: C26H21ClN4 MolecularWeight: 424.92474

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C=C(C3=C2N=CN=C3NCC4=CC=CC=C4)C5=CC=CC=C5)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)N2C=C(C3=C2N=CN=C3NCC4=CC=CC=C4)C5=CC=CC=C5)Cl

InChI

InChI=1S/C26H21ClN4/c1-18-12-13-21(14-23(18)27)31-16-22(20-10-6-3-7-11-20)24-25(29-17-30-26(24)31)28-15-19-8-4-2-5-9-19/h2-14,16-17H,15H2,1H3,(H,28,29,30)