N-[2-(2-azanyl-2-oxidanylidene-ethyl)sulfanylphenyl]-1-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperidine-4-carboxamide

Systemtic Name: N-[2-(2-azanyl-2-oxidanylidene-ethyl)sulfanylphenyl]-1-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperidine-4-carboxamide Openeye Name: N-[2-(2-amino-2-oxo-ethyl)sulfanylphenyl]-1-indan-5-ylsulfonyl-piperidine-4-carboxamide CAS Name: N-[2-[(2-amino-2-oxoethyl)thio]phenyl]-1-(2,3-dihydro-1H-inden-5-ylsulfonyl)-4-piperidinecarboxamide IUPAC Name: N-[2-(2-amino-2-oxoethyl)sulfanylphenyl]-1-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperidine-4-carboxamide Traditional Name: N-[2-[(2-amino-2-keto-ethyl)thio]phenyl]-1-indan-5-ylsulfonyl-isonipecotamide Formula: C23H27N3O4S2 MolecularWeight: 473.60818

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C(C=C2)S(=O)(=O)N3CCC(CC3)C(=O)NC4=CC=CC=C4SCC(=O)N

Isomeric SMILES

C1CC2=C(C1)C=C(C=C2)S(=O)(=O)N3CCC(CC3)C(=O)NC4=CC=CC=C4SCC(=O)N

InChI

InChI=1S/C23H27N3O4S2/c24-22(27)15-31-21-7-2-1-6-20(21)25-23(28)17-10-12-26(13-11-17)32(29,30)19-9-8-16-4-3-5-18(16)14-19/h1-2,6-9,14,17H,3-5,10-13,15H2,(H2,24,27)(H,25,28)