methyl 3-[[4-(4-thiophen-3-ylphenyl)sulfonylpiperidin-1-yl]carbonylamino]benzoate

Systemtic Name: methyl 3-[[4-(4-thiophen-3-ylphenyl)sulfonylpiperidin-1-yl]carbonylamino]benzoate Openeye Name: methyl 3-[[4-[4-(3-thienyl)phenyl]sulfonylpiperidine-1-carbonyl]amino]benzoate CAS Name: 3-[[oxo-[4-[4-(3-thiophenyl)phenyl]sulfonyl-1-piperidinyl]methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[[4-(4-thiophen-3-ylphenyl)sulfonylpiperidine-1-carbonyl]amino]benzoate Traditional Name: 3-[[4-[4-(3-thienyl)phenyl]sulfonylpiperidine-1-carbonyl]amino]benzoic acid methyl ester Formula: C24H24N2O5S2 MolecularWeight: 484.58776

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)NC(=O)N2CCC(CC2)S(=O)(=O)C3=CC=C(C=C3)C4=CSC=C4

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)NC(=O)N2CCC(CC2)S(=O)(=O)C3=CC=C(C=C3)C4=CSC=C4

InChI

InChI=1S/C24H24N2O5S2/c1-31-23(27)18-3-2-4-20(15-18)25-24(28)26-12-9-22(10-13-26)33(29,30)21-7-5-17(6-8-21)19-11-14-32-16-19/h2-8,11,14-16,22H,9-10,12-13H2,1H3,(H,25,28)