(5-chloranylthiophen-2-yl)methyl-[[2-(4-ethanoylpiperazin-1-yl)pyridin-3-yl]methyl]azanium

Systemtic Name: (5-chloranylthiophen-2-yl)methyl-[[2-(4-ethanoylpiperazin-1-yl)pyridin-3-yl]methyl]azanium Openeye Name: [2-(4-acetylpiperazin-1-yl)-3-pyridyl]methyl-[(5-chloro-2-thienyl)methyl]ammonium CAS Name: [2-(4-acetyl-1-piperazinyl)-3-pyridinyl]methyl-[(5-chloro-2-thiophenyl)methyl]ammonium IUPAC Name: [2-(4-acetylpiperazin-1-yl)pyridin-3-yl]methyl-[(5-chlorothiophen-2-yl)methyl]azanium Traditional Name: [2-(4-acetylpiperazino)-3-pyridyl]methyl-[(5-chloro-2-thienyl)methyl]ammonium Formula: C17H22ClN4OS+ MolecularWeight: 365.90078

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C2=C(C=CC=N2)C[NH2+]CC3=CC=C(S3)Cl

Isomeric SMILES

CC(=O)N1CCN(CC1)C2=C(C=CC=N2)C[NH2+]CC3=CC=C(S3)Cl

InChI

InChI=1S/C17H21ClN4OS/c1-13(23)21-7-9-22(10-8-21)17-14(3-2-6-20-17)11-19-12-15-4-5-16(18)24-15/h2-6,19H,7-12H2,1H3/p+1