(4-methylsulfanyl-3-nitro-phenyl)-[4-[1-(2-thiophen-3-ylethyl)imidazol-2-yl]piperidin-1-yl]methanone

Systemtic Name: (4-methylsulfanyl-3-nitro-phenyl)-[4-[1-(2-thiophen-3-ylethyl)imidazol-2-yl]piperidin-1-yl]methanone Openeye Name: (4-methylsulfanyl-3-nitro-phenyl)-[4-[1-[2-(3-thienyl)ethyl]imidazol-2-yl]-1-piperidyl]methanone CAS Name: [4-(methylthio)-3-nitrophenyl]-[4-[1-[2-(3-thiophenyl)ethyl]-2-imidazolyl]-1-piperidinyl]methanone IUPAC Name: (4-methylsulfanyl-3-nitrophenyl)-[4-[1-(2-thiophen-3-ylethyl)imidazol-2-yl]piperidin-1-yl]methanone Traditional Name: [4-(methylthio)-3-nitro-phenyl]-[4-[1-[2-(3-thienyl)ethyl]imidazol-2-yl]piperidino]methanone Formula: C22H24N4O3S2 MolecularWeight: 456.58096

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=C(C=C1)C(=O)N2CCC(CC2)C3=NC=CN3CCC4=CSC=C4)[N+](=O)[O-]

Isomeric SMILES

CSC1=C(C=C(C=C1)C(=O)N2CCC(CC2)C3=NC=CN3CCC4=CSC=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H24N4O3S2/c1-30-20-3-2-18(14-19(20)26(28)29)22(27)25-10-5-17(6-11-25)21-23-8-12-24(21)9-4-16-7-13-31-15-16/h2-3,7-8,12-15,17H,4-6,9-11H2,1H3