2-but-1-ynyl-3-piperazin-1-yl-4-pyridin-2-yl-aniline

Systemtic Name: 2-but-1-ynyl-3-piperazin-1-yl-4-pyridin-2-yl-aniline Openeye Name: 2-but-1-ynyl-3-piperazin-1-yl-4-(2-pyridyl)aniline CAS Name: 2-but-1-ynyl-3-(1-piperazinyl)-4-(2-pyridinyl)aniline IUPAC Name: 2-but-1-ynyl-3-piperazin-1-yl-4-pyridin-2-ylaniline Traditional Name: [2-but-1-ynyl-3-piperazino-4-(2-pyridyl)phenyl]amine Formula: C19H22N4 MolecularWeight: 306.40478

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Descriptors Computed from Structure

Canonical SMILES:

CCC#CC1=C(C=CC(=C1N2CCNCC2)C3=CC=CC=N3)N

Isomeric SMILES

CCC#CC1=C(C=CC(=C1N2CCNCC2)C3=CC=CC=N3)N

InChI

InChI=1S/C19H22N4/c1-2-3-6-15-17(20)9-8-16(18-7-4-5-10-22-18)19(15)23-13-11-21-12-14-23/h4-5,7-10,21H,2,11-14,20H2,1H3