5-[2-(3,5-dimethoxyphenyl)-1-methyl-3-thiophen-2-yl-indol-5-yl]pyrimidin-2-amine

Systemtic Name: 5-[2-(3,5-dimethoxyphenyl)-1-methyl-3-thiophen-2-yl-indol-5-yl]pyrimidin-2-amine Openeye Name: 5-[2-(3,5-dimethoxyphenyl)-1-methyl-3-(2-thienyl)indol-5-yl]pyrimidin-2-amine CAS Name: 5-[2-(3,5-dimethoxyphenyl)-1-methyl-3-thiophen-2-yl-5-indolyl]-2-pyrimidinamine IUPAC Name: 5-[2-(3,5-dimethoxyphenyl)-1-methyl-3-thiophen-2-ylindol-5-yl]pyrimidin-2-amine Traditional Name: [5-[2-(3,5-dimethoxyphenyl)-1-methyl-3-(2-thienyl)indol-5-yl]pyrimidin-2-yl]amine Formula: C25H22N4O2S MolecularWeight: 442.53278

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)C3=CN=C(N=C3)N)C(=C1C4=CC(=CC(=C4)OC)OC)C5=CC=CS5

Isomeric SMILES

CN1C2=C(C=C(C=C2)C3=CN=C(N=C3)N)C(=C1C4=CC(=CC(=C4)OC)OC)C5=CC=CS5

InChI

InChI=1S/C25H22N4O2S/c1-29-21-7-6-15(17-13-27-25(26)28-14-17)11-20(21)23(22-5-4-8-32-22)24(29)16-9-18(30-2)12-19(10-16)31-3/h4-14H,1-3H3,(H2,26,27,28)