2-chloranyl-N-[2-(4-methylpiperazin-1-yl)-2-thiophen-2-yl-ethyl]-4-nitro-aniline

Systemtic Name: 2-chloranyl-N-[2-(4-methylpiperazin-1-yl)-2-thiophen-2-yl-ethyl]-4-nitro-aniline Openeye Name: 2-chloro-N-[2-(4-methylpiperazin-1-yl)-2-(2-thienyl)ethyl]-4-nitro-aniline CAS Name: 2-chloro-N-[2-(4-methyl-1-piperazinyl)-2-thiophen-2-ylethyl]-4-nitroaniline IUPAC Name: 2-chloro-N-[2-(4-methylpiperazin-1-yl)-2-thiophen-2-ylethyl]-4-nitroaniline Traditional Name: (2-chloro-4-nitro-phenyl)-[2-(4-methylpiperazino)-2-(2-thienyl)ethyl]amine Formula: C17H21ClN4O2S MolecularWeight: 380.89224

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(CNC2=C(C=C(C=C2)[N+](=O)[O-])Cl)C3=CC=CS3

Isomeric SMILES

CN1CCN(CC1)C(CNC2=C(C=C(C=C2)[N+](=O)[O-])Cl)C3=CC=CS3

InChI

InChI=1S/C17H21ClN4O2S/c1-20-6-8-21(9-7-20)16(17-3-2-10-25-17)12-19-15-5-4-13(22(23)24)11-14(15)18/h2-5,10-11,16,19H,6-9,12H2,1H3