[4-[4-fluoranyl-5-(4-methylpiperidin-1-yl)-2-nitro-phenyl]piperazin-1-yl]-thiophen-2-yl-methanone

Systemtic Name: [4-[4-fluoranyl-5-(4-methylpiperidin-1-yl)-2-nitro-phenyl]piperazin-1-yl]-thiophen-2-yl-methanone Openeye Name: [4-[4-fluoro-5-(4-methyl-1-piperidyl)-2-nitro-phenyl]piperazin-1-yl]-(2-thienyl)methanone CAS Name: [4-[4-fluoro-5-(4-methyl-1-piperidinyl)-2-nitrophenyl]-1-piperazinyl]-thiophen-2-ylmethanone IUPAC Name: [4-[4-fluoro-5-(4-methylpiperidin-1-yl)-2-nitrophenyl]piperazin-1-yl]-thiophen-2-ylmethanone Traditional Name: [4-[4-fluoro-5-(4-methylpiperidino)-2-nitro-phenyl]piperazino]-(2-thienyl)methanone Formula: C21H25FN4O3S MolecularWeight: 432.511603

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=C(C=C(C(=C2)N3CCN(CC3)C(=O)C4=CC=CS4)[N+](=O)[O-])F

Isomeric SMILES

CC1CCN(CC1)C2=C(C=C(C(=C2)N3CCN(CC3)C(=O)C4=CC=CS4)[N+](=O)[O-])F

InChI

InChI=1S/C21H25FN4O3S/c1-15-4-6-23(7-5-15)17-14-18(19(26(28)29)13-16(17)22)24-8-10-25(11-9-24)21(27)20-3-2-12-30-20/h2-3,12-15H,4-11H2,1H3