4-methyl-N-[2-[(5-phenylazanyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethyl]benzenesulfonamide

Systemtic Name: 4-methyl-N-[2-[(5-phenylazanyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethyl]benzenesulfonamide Openeye Name: N-[2-[(5-anilino-1,3,4-thiadiazol-2-yl)sulfanyl]ethyl]-4-methyl-benzenesulfonamide CAS Name: N-[2-[(5-anilino-1,3,4-thiadiazol-2-yl)thio]ethyl]-4-methylbenzenesulfonamide IUPAC Name: N-[2-[(5-anilino-1,3,4-thiadiazol-2-yl)sulfanyl]ethyl]-4-methylbenzenesulfonamide Traditional Name: N-[2-[(5-anilino-1,3,4-thiadiazol-2-yl)thio]ethyl]-4-methyl-benzenesulfonamide Formula: C17H18N4O2S3 MolecularWeight: 406.54542

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCCSC2=NN=C(S2)NC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCCSC2=NN=C(S2)NC3=CC=CC=C3

InChI

InChI=1S/C17H18N4O2S3/c1-13-7-9-15(10-8-13)26(22,23)18-11-12-24-17-21-20-16(25-17)19-14-5-3-2-4-6-14/h2-10,18H,11-12H2,1H3,(H,19,20)