(2,5-dimethylthiophen-3-yl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone

Systemtic Name: (2,5-dimethylthiophen-3-yl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone Openeye Name: (2,5-dimethyl-3-thienyl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone CAS Name: (2,5-dimethyl-3-thiophenyl)-[4-(4-nitrophenyl)-1-piperazinyl]methanone IUPAC Name: (2,5-dimethylthiophen-3-yl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone Traditional Name: (2,5-dimethyl-3-thienyl)-[4-(4-nitrophenyl)piperazino]methanone Formula: C17H19N3O3S MolecularWeight: 345.41606

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19N3O3S/c1-12-11-16(13(2)24-12)17(21)19-9-7-18(8-10-19)14-3-5-15(6-4-14)20(22)23/h3-6,11H,7-10H2,1-2H3