4-(1H-indol-2-yl)-N-[(3,4,5-trimethoxyphenyl)methyl]pyrimidin-2-amine

Systemtic Name: 4-(1H-indol-2-yl)-N-[(3,4,5-trimethoxyphenyl)methyl]pyrimidin-2-amine Openeye Name: 4-(1H-indol-2-yl)-N-[(3,4,5-trimethoxyphenyl)methyl]pyrimidin-2-amine CAS Name: 4-(1H-indol-2-yl)-N-[(3,4,5-trimethoxyphenyl)methyl]-2-pyrimidinamine IUPAC Name: 4-(1H-indol-2-yl)-N-[(3,4,5-trimethoxyphenyl)methyl]pyrimidin-2-amine Traditional Name: [4-(1H-indol-2-yl)pyrimidin-2-yl]-(3,4,5-trimethoxybenzyl)amine Formula: C22H22N4O3 MolecularWeight: 390.43508

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CNC2=NC=CC(=N2)C3=CC4=CC=CC=C4N3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)CNC2=NC=CC(=N2)C3=CC4=CC=CC=C4N3

InChI

InChI=1S/C22H22N4O3/c1-27-19-10-14(11-20(28-2)21(19)29-3)13-24-22-23-9-8-17(26-22)18-12-15-6-4-5-7-16(15)25-18/h4-12,25H,13H2,1-3H3,(H,23,24,26)