(4-methylsulfanyl-3-nitro-phenyl)-[2-(4-thiophen-2-ylcarbonylpiperazin-1-yl)carbonylphenyl]methanone

Systemtic Name: (4-methylsulfanyl-3-nitro-phenyl)-[2-(4-thiophen-2-ylcarbonylpiperazin-1-yl)carbonylphenyl]methanone Openeye Name: (4-methylsulfanyl-3-nitro-phenyl)-[2-[4-(thiophene-2-carbonyl)piperazine-1-carbonyl]phenyl]methanone CAS Name: [4-(methylthio)-3-nitrophenyl]-[2-[oxo-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]methyl]phenyl]methanone IUPAC Name: (4-methylsulfanyl-3-nitrophenyl)-[2-[4-(thiophene-2-carbonyl)piperazine-1-carbonyl]phenyl]methanone Traditional Name: [4-(methylthio)-3-nitro-phenyl]-[2-[4-(2-thenoyl)piperazine-1-carbonyl]phenyl]methanone Formula: C24H21N3O5S2 MolecularWeight: 495.57064

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=C(C=C1)C(=O)C2=CC=CC=C2C(=O)N3CCN(CC3)C(=O)C4=CC=CS4)[N+](=O)[O-]

Isomeric SMILES

CSC1=C(C=C(C=C1)C(=O)C2=CC=CC=C2C(=O)N3CCN(CC3)C(=O)C4=CC=CS4)[N+](=O)[O-]

InChI

InChI=1S/C24H21N3O5S2/c1-33-20-9-8-16(15-19(20)27(31)32)22(28)17-5-2-3-6-18(17)23(29)25-10-12-26(13-11-25)24(30)21-7-4-14-34-21/h2-9,14-15H,10-13H2,1H3