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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(S1)C(=O)N2CCN(CC2)C3=CC=CC=C3[N+](=O)[O-])C

Isomeric SMILES

CCC1=C(C=C(S1)C(=O)N2CCN(CC2)C3=CC=CC=C3[N+](=O)[O-])C

InChI

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