3-(2-morpholin-4-ylethyl)-5,6-diphenyl-7-(phenylmethyl)pyrrolo[2,3-d]pyrimidin-3-ium-4-amine

Systemtic Name: 3-(2-morpholin-4-ylethyl)-5,6-diphenyl-7-(phenylmethyl)pyrrolo[2,3-d]pyrimidin-3-ium-4-amine Openeye Name: 7-benzyl-3-(2-morpholinoethyl)-5,6-diphenyl-pyrrolo[2,3-d]pyrimidin-3-ium-4-amine CAS Name: 3-[2-(4-morpholinyl)ethyl]-5,6-diphenyl-7-(phenylmethyl)-4-pyrrolo[2,3-d]pyrimidin-3-iumamine IUPAC Name: 7-benzyl-3-(2-morpholin-4-ylethyl)-5,6-diphenylpyrrolo[2,3-d]pyrimidin-3-ium-4-amine Traditional Name: [7-benzyl-3-(2-morpholinoethyl)-5,6-diphenyl-pyrrolo[2,3-d]pyrimidin-3-ium-4-yl]amine Formula: C31H32N5O+ MolecularWeight: 490.61868

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CC[N+]2=C(C3=C(N=C2)N(C(=C3C4=CC=CC=C4)C5=CC=CC=C5)CC6=CC=CC=C6)N

Isomeric SMILES

C1COCCN1CC[N+]2=C(C3=C(N=C2)N(C(=C3C4=CC=CC=C4)C5=CC=CC=C5)CC6=CC=CC=C6)N

InChI

InChI=1S/C31H31N5O/c32-30-28-27(25-12-6-2-7-13-25)29(26-14-8-3-9-15-26)36(22-24-10-4-1-5-11-24)31(28)33-23-35(30)17-16-34-18-20-37-21-19-34/h1-15,23,32H,16-22H2/p+1