N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-2-[2-(2-methylphenoxy)ethanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-2-[2-(2-methylphenoxy)ethanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: N-[(3S)-1,1-dioxothiolan-3-yl]-2-[[2-(2-methylphenoxy)acetyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: N-[(3S)-1,1-dioxo-3-thiolanyl]-2-[[2-(2-methylphenoxy)-1-oxoethyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: N-[(3S)-1,1-dioxothiolan-3-yl]-2-[[2-(2-methylphenoxy)acetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: N-[(3S)-1,1-diketothiolan-3-yl]-2-[[2-(2-methylphenoxy)acetyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C22H26N2O5S2 MolecularWeight: 462.58224

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCC(=O)NC2=C(C3=C(S2)CCCC3)C(=O)NC4CCS(=O)(=O)C4

Isomeric SMILES

CC1=CC=CC=C1OCC(=O)NC2=C(C3=C(S2)CCCC3)C(=O)N[C@H]4CCS(=O)(=O)C4

InChI

InChI=1S/C22H26N2O5S2/c1-14-6-2-4-8-17(14)29-12-19(25)24-22-20(16-7-3-5-9-18(16)30-22)21(26)23-15-10-11-31(27,28)13-15/h2,4,6,8,15H,3,5,7,9-13H2,1H3,(H,23,26)(H,24,25)/t15-/m0/s1