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

Systemtic Name: 7-(4-methyl-3-nitro-phenyl)-N-(3,4,5-trimethoxyphenyl)pyrrolo[2,3-d]pyrimidin-2-amine Openeye Name: 7-(4-methyl-3-nitro-phenyl)-N-(3,4,5-trimethoxyphenyl)pyrrolo[2,3-d]pyrimidin-2-amine CAS Name: 7-(4-methyl-3-nitrophenyl)-N-(3,4,5-trimethoxyphenyl)-2-pyrrolo[2,3-d]pyrimidinamine IUPAC Name: 7-(4-methyl-3-nitrophenyl)-N-(3,4,5-trimethoxyphenyl)pyrrolo[2,3-d]pyrimidin-2-amine Traditional Name: [7-(4-methyl-3-nitro-phenyl)pyrrolo[2,3-d]pyrimidin-2-yl]-(3,4,5-trimethoxyphenyl)amine Formula: C22H21N5O5 MolecularWeight: 435.43264

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C=CC3=CN=C(N=C32)NC4=CC(=C(C(=C4)OC)OC)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)N2C=CC3=CN=C(N=C32)NC4=CC(=C(C(=C4)OC)OC)OC)[N+](=O)[O-]

InChI

InChI=1S/C22H21N5O5/c1-13-5-6-16(11-17(13)27(28)29)26-8-7-14-12-23-22(25-21(14)26)24-15-9-18(30-2)20(32-4)19(10-15)31-3/h5-12H,1-4H3,(H,23,24,25)