3-(2-piperidin-1-ylpyrimidin-4-yl)-1-prop-2-ynyl-indole

Systemtic Name: 3-(2-piperidin-1-ylpyrimidin-4-yl)-1-prop-2-ynyl-indole Openeye Name: 3-[2-(1-piperidyl)pyrimidin-4-yl]-1-prop-2-ynyl-indole CAS Name: 3-[2-(1-piperidinyl)-4-pyrimidinyl]-1-prop-2-ynylindole IUPAC Name: 3-(2-piperidin-1-ylpyrimidin-4-yl)-1-prop-2-ynylindole Traditional Name: 3-(2-piperidinopyrimidin-4-yl)-1-propargyl-indole Formula: C20H20N4 MolecularWeight: 316.3996

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Descriptors Computed from Structure

Canonical SMILES:

C#CCN1C=C(C2=CC=CC=C21)C3=NC(=NC=C3)N4CCCCC4

Isomeric SMILES

C#CCN1C=C(C2=CC=CC=C21)C3=NC(=NC=C3)N4CCCCC4

InChI

InChI=1S/C20H20N4/c1-2-12-24-15-17(16-8-4-5-9-19(16)24)18-10-11-21-20(22-18)23-13-6-3-7-14-23/h1,4-5,8-11,15H,3,6-7,12-14H2