2-but-1-ynyl-5-piperazin-1-yl-4-pyridin-2-yl-pyridin-3-amine

Systemtic Name: 2-but-1-ynyl-5-piperazin-1-yl-4-pyridin-2-yl-pyridin-3-amine Openeye Name: 2-but-1-ynyl-5-piperazin-1-yl-4-(2-pyridyl)pyridin-3-amine CAS Name: 2-but-1-ynyl-5-(1-piperazinyl)-4-(2-pyridinyl)-3-pyridinamine IUPAC Name: 2-but-1-ynyl-5-piperazin-1-yl-4-pyridin-2-ylpyridin-3-amine Traditional Name: [2-but-1-ynyl-5-piperazino-4-(2-pyridyl)-3-pyridyl]amine Formula: C18H21N5 MolecularWeight: 307.39284

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Descriptors Computed from Structure

Canonical SMILES:

CCC#CC1=NC=C(C(=C1N)C2=CC=CC=N2)N3CCNCC3

Isomeric SMILES

CCC#CC1=NC=C(C(=C1N)C2=CC=CC=N2)N3CCNCC3

InChI

InChI=1S/C18H21N5/c1-2-3-6-15-18(19)17(14-7-4-5-8-21-14)16(13-22-15)23-11-9-20-10-12-23/h4-5,7-8,13,20H,2,9-12,19H2,1H3