N-[5-(1,3-benzodioxol-5-yl)-1,3,4-thiadiazol-2-yl]-3-methyl-2-(quinolin-8-ylsulfonylamino)pentanamide

Systemtic Name: N-[5-(1,3-benzodioxol-5-yl)-1,3,4-thiadiazol-2-yl]-3-methyl-2-(quinolin-8-ylsulfonylamino)pentanamide Openeye Name: N-[5-(1,3-benzodioxol-5-yl)-1,3,4-thiadiazol-2-yl]-3-methyl-2-(8-quinolylsulfonylamino)pentanamide CAS Name: N-[5-(1,3-benzodioxol-5-yl)-1,3,4-thiadiazol-2-yl]-3-methyl-2-(8-quinolinylsulfonylamino)pentanamide IUPAC Name: N-[5-(1,3-benzodioxol-5-yl)-1,3,4-thiadiazol-2-yl]-3-methyl-2-(quinolin-8-ylsulfonylamino)pentanamide Traditional Name: N-[5-(1,3-benzodioxol-5-yl)-1,3,4-thiadiazol-2-yl]-3-methyl-2-(8-quinolylsulfonylamino)valeramide Formula: C24H23N5O5S2 MolecularWeight: 525.59992

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC1=NN=C(S1)C2=CC3=C(C=C2)OCO3)NS(=O)(=O)C4=CC=CC5=C4N=CC=C5

Isomeric SMILES

CCC(C)C(C(=O)NC1=NN=C(S1)C2=CC3=C(C=C2)OCO3)NS(=O)(=O)C4=CC=CC5=C4N=CC=C5

InChI

InChI=1S/C24H23N5O5S2/c1-3-14(2)20(29-36(31,32)19-8-4-6-15-7-5-11-25-21(15)19)22(30)26-24-28-27-23(35-24)16-9-10-17-18(12-16)34-13-33-17/h4-12,14,20,29H,3,13H2,1-2H3,(H,26,28,30)