[4-(4-chloranyl-2-nitro-phenyl)piperazin-1-yl]-(5-ethyl-4-methyl-thiophen-2-yl)methanone

Systemtic Name: [4-(4-chloranyl-2-nitro-phenyl)piperazin-1-yl]-(5-ethyl-4-methyl-thiophen-2-yl)methanone Openeye Name: [4-(4-chloro-2-nitro-phenyl)piperazin-1-yl]-(5-ethyl-4-methyl-2-thienyl)methanone CAS Name: [4-(4-chloro-2-nitrophenyl)-1-piperazinyl]-(5-ethyl-4-methyl-2-thiophenyl)methanone IUPAC Name: [4-(4-chloro-2-nitrophenyl)piperazin-1-yl]-(5-ethyl-4-methylthiophen-2-yl)methanone Traditional Name: [4-(4-chloro-2-nitro-phenyl)piperazino]-(5-ethyl-4-methyl-2-thienyl)methanone Formula: C18H20ClN3O3S MolecularWeight: 393.8877

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20ClN3O3S/c1-3-16-12(2)10-17(26-16)18(23)21-8-6-20(7-9-21)14-5-4-13(19)11-15(14)22(24)25/h4-5,10-11H,3,6-9H2,1-2H3