(2R)-1-(4-fluorophenyl)sulfonyl-N-[(3S)-2-oxidanylidenepiperidin-3-yl]-4-thiophen-2-ylcarbonyl-piperazine-2-carboxamide

Systemtic Name: (2R)-1-(4-fluorophenyl)sulfonyl-N-[(3S)-2-oxidanylidenepiperidin-3-yl]-4-thiophen-2-ylcarbonyl-piperazine-2-carboxamide Openeye Name: (2R)-1-(4-fluorophenyl)sulfonyl-N-[(3S)-2-oxo-3-piperidyl]-4-(thiophene-2-carbonyl)piperazine-2-carboxamide CAS Name: (2R)-1-(4-fluorophenyl)sulfonyl-N-[(3S)-2-oxo-3-piperidinyl]-4-[oxo(thiophen-2-yl)methyl]-2-piperazinecarboxamide IUPAC Name: (2R)-1-(4-fluorophenyl)sulfonyl-N-[(3S)-2-oxopiperidin-3-yl]-4-(thiophene-2-carbonyl)piperazine-2-carboxamide Traditional Name: (2R)-1-(4-fluorophenyl)sulfonyl-N-[(3S)-2-keto-3-piperidyl]-4-(2-thenoyl)piperazine-2-carboxamide Formula: C21H23FN4O5S2 MolecularWeight: 494.559523

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(=O)NC1)NC(=O)C2CN(CCN2S(=O)(=O)C3=CC=C(C=C3)F)C(=O)C4=CC=CS4

Isomeric SMILES

C1C[C@@H](C(=O)NC1)NC(=O)[C@H]2CN(CCN2S(=O)(=O)C3=CC=C(C=C3)F)C(=O)C4=CC=CS4

InChI

InChI=1S/C21H23FN4O5S2/c22-14-5-7-15(8-6-14)33(30,31)26-11-10-25(21(29)18-4-2-12-32-18)13-17(26)20(28)24-16-3-1-9-23-19(16)27/h2,4-8,12,16-17H,1,3,9-11,13H2,(H,23,27)(H,24,28)/t16-,17+/m0/s1