N-(3-chlorophenyl)-5,6-diphenyl-7-(phenylmethyl)pyrrolo[2,3-d]pyrimidin-4-amine

Systemtic Name: N-(3-chlorophenyl)-5,6-diphenyl-7-(phenylmethyl)pyrrolo[2,3-d]pyrimidin-4-amine Openeye Name: 7-benzyl-N-(3-chlorophenyl)-5,6-diphenyl-pyrrolo[2,3-d]pyrimidin-4-amine CAS Name: N-(3-chlorophenyl)-5,6-diphenyl-7-(phenylmethyl)-4-pyrrolo[2,3-d]pyrimidinamine IUPAC Name: 7-benzyl-N-(3-chlorophenyl)-5,6-diphenylpyrrolo[2,3-d]pyrimidin-4-amine Traditional Name: (7-benzyl-5,6-diphenyl-pyrrolo[2,3-d]pyrimidin-4-yl)-(3-chlorophenyl)amine Formula: C31H23ClN4 MolecularWeight: 486.99412

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=C(C3=C2N=CN=C3NC4=CC(=CC=C4)Cl)C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=C(C3=C2N=CN=C3NC4=CC(=CC=C4)Cl)C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C31H23ClN4/c32-25-17-10-18-26(19-25)35-30-28-27(23-13-6-2-7-14-23)29(24-15-8-3-9-16-24)36(31(28)34-21-33-30)20-22-11-4-1-5-12-22/h1-19,21H,20H2,(H,33,34,35)