N-[(2S)-2-(1H-indol-3-yl)-2-(4-methoxyphenyl)ethyl]-4-methoxy-pyrimidin-2-amine

Systemtic Name: N-[(2S)-2-(1H-indol-3-yl)-2-(4-methoxyphenyl)ethyl]-4-methoxy-pyrimidin-2-amine Openeye Name: N-[(2S)-2-(1H-indol-3-yl)-2-(4-methoxyphenyl)ethyl]-4-methoxy-pyrimidin-2-amine CAS Name: N-[(2S)-2-(1H-indol-3-yl)-2-(4-methoxyphenyl)ethyl]-4-methoxy-2-pyrimidinamine IUPAC Name: N-[(2S)-2-(1H-indol-3-yl)-2-(4-methoxyphenyl)ethyl]-4-methoxypyrimidin-2-amine Traditional Name: [(2S)-2-(1H-indol-3-yl)-2-(4-methoxyphenyl)ethyl]-(4-methoxypyrimidin-2-yl)amine Formula: C22H22N4O2 MolecularWeight: 374.43568

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(CNC2=NC=CC(=N2)OC)C3=CNC4=CC=CC=C43

Isomeric SMILES

COC1=CC=C(C=C1)[C@H](CNC2=NC=CC(=N2)OC)C3=CNC4=CC=CC=C43

InChI

InChI=1S/C22H22N4O2/c1-27-16-9-7-15(8-10-16)18(13-25-22-23-12-11-21(26-22)28-2)19-14-24-20-6-4-3-5-17(19)20/h3-12,14,18,24H,13H2,1-2H3,(H,23,25,26)/t18-/m0/s1