(4-ethyl-5-methyl-thiophen-2-yl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone

Systemtic Name: (4-ethyl-5-methyl-thiophen-2-yl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone Openeye Name: (4-ethyl-5-methyl-2-thienyl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone CAS Name: (4-ethyl-5-methyl-2-thiophenyl)-[4-(4-nitrophenyl)-1-piperazinyl]methanone IUPAC Name: (4-ethyl-5-methylthiophen-2-yl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone Traditional Name: (4-ethyl-5-methyl-2-thienyl)-[4-(4-nitrophenyl)piperazino]methanone Formula: C18H21N3O3S MolecularWeight: 359.44264

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=C1)C(=O)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-])C

Isomeric SMILES

CCC1=C(SC(=C1)C(=O)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-])C

InChI

InChI=1S/C18H21N3O3S/c1-3-14-12-17(25-13(14)2)18(22)20-10-8-19(9-11-20)15-4-6-16(7-5-15)21(23)24/h4-7,12H,3,8-11H2,1-2H3