N-[5-(3-phenylpropylsulfanyl)-1,3,4-thiadiazol-2-yl]-3-(phenylsulfonylamino)propanamide

Systemtic Name: N-[5-(3-phenylpropylsulfanyl)-1,3,4-thiadiazol-2-yl]-3-(phenylsulfonylamino)propanamide Openeye Name: 3-(benzenesulfonamido)-N-[5-(3-phenylpropylsulfanyl)-1,3,4-thiadiazol-2-yl]propanamide CAS Name: 3-(benzenesulfonamido)-N-[5-(3-phenylpropylthio)-1,3,4-thiadiazol-2-yl]propanamide IUPAC Name: 3-(benzenesulfonamido)-N-[5-(3-phenylpropylsulfanyl)-1,3,4-thiadiazol-2-yl]propanamide Traditional Name: 3-(benzenesulfonamido)-N-[5-(3-phenylpropylthio)-1,3,4-thiadiazol-2-yl]propionamide Formula: C20H22N4O3S3 MolecularWeight: 462.60868

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCSC2=NN=C(S2)NC(=O)CCNS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CCCSC2=NN=C(S2)NC(=O)CCNS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H22N4O3S3/c25-18(13-14-21-30(26,27)17-11-5-2-6-12-17)22-19-23-24-20(29-19)28-15-7-10-16-8-3-1-4-9-16/h1-6,8-9,11-12,21H,7,10,13-15H2,(H,22,23,25)