2-butylsulfanyl-N-[5-[2-[(4-methylphenyl)sulfonylamino]ethyl]-1,3,4-thiadiazol-2-yl]benzamide

Systemtic Name: 2-butylsulfanyl-N-[5-[2-[(4-methylphenyl)sulfonylamino]ethyl]-1,3,4-thiadiazol-2-yl]benzamide Openeye Name: 2-butylsulfanyl-N-[5-[2-(p-tolylsulfonylamino)ethyl]-1,3,4-thiadiazol-2-yl]benzamide CAS Name: 2-(butylthio)-N-[5-[2-[(4-methylphenyl)sulfonylamino]ethyl]-1,3,4-thiadiazol-2-yl]benzamide IUPAC Name: 2-butylsulfanyl-N-[5-[2-[(4-methylphenyl)sulfonylamino]ethyl]-1,3,4-thiadiazol-2-yl]benzamide Traditional Name: 2-(butylthio)-N-[5-[2-(tosylamino)ethyl]-1,3,4-thiadiazol-2-yl]benzamide Formula: C22H26N4O3S3 MolecularWeight: 490.66184

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=CC=CC=C1C(=O)NC2=NN=C(S2)CCNS(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCCCSC1=CC=CC=C1C(=O)NC2=NN=C(S2)CCNS(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C22H26N4O3S3/c1-3-4-15-30-19-8-6-5-7-18(19)21(27)24-22-26-25-20(31-22)13-14-23-32(28,29)17-11-9-16(2)10-12-17/h5-12,23H,3-4,13-15H2,1-2H3,(H,24,26,27)