[4-(5-bromanylpyridin-2-yl)piperazin-1-yl]-(5-methyl-4-nitro-thiophen-2-yl)methanone

Systemtic Name: [4-(5-bromanylpyridin-2-yl)piperazin-1-yl]-(5-methyl-4-nitro-thiophen-2-yl)methanone Openeye Name: [4-(5-bromo-2-pyridyl)piperazin-1-yl]-(5-methyl-4-nitro-2-thienyl)methanone CAS Name: [4-(5-bromo-2-pyridinyl)-1-piperazinyl]-(5-methyl-4-nitro-2-thiophenyl)methanone IUPAC Name: [4-(5-bromopyridin-2-yl)piperazin-1-yl]-(5-methyl-4-nitrothiophen-2-yl)methanone Traditional Name: [4-(5-bromo-2-pyridyl)piperazino]-(5-methyl-4-nitro-2-thienyl)methanone Formula: C15H15BrN4O3S MolecularWeight: 411.2736

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(S1)C(=O)N2CCN(CC2)C3=NC=C(C=C3)Br)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(S1)C(=O)N2CCN(CC2)C3=NC=C(C=C3)Br)[N+](=O)[O-]

InChI

InChI=1S/C15H15BrN4O3S/c1-10-12(20(22)23)8-13(24-10)15(21)19-6-4-18(5-7-19)14-3-2-11(16)9-17-14/h2-3,8-9H,4-7H2,1H3