2-[(4-methylphenyl)sulfonylamino]-4-methylsulfanyl-N-(1,3,4-thiadiazol-2-yl)butanamide

Systemtic Name: 2-[(4-methylphenyl)sulfonylamino]-4-methylsulfanyl-N-(1,3,4-thiadiazol-2-yl)butanamide Openeye Name: 4-methylsulfanyl-2-(p-tolylsulfonylamino)-N-(1,3,4-thiadiazol-2-yl)butanamide CAS Name: 2-[(4-methylphenyl)sulfonylamino]-4-(methylthio)-N-(1,3,4-thiadiazol-2-yl)butanamide IUPAC Name: 2-[(4-methylphenyl)sulfonylamino]-4-methylsulfanyl-N-(1,3,4-thiadiazol-2-yl)butanamide Traditional Name: 4-(methylthio)-N-(1,3,4-thiadiazol-2-yl)-2-(tosylamino)butyramide Formula: C14H18N4O3S3 MolecularWeight: 386.51272

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CCSC)C(=O)NC2=NN=CS2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(CCSC)C(=O)NC2=NN=CS2

InChI

InChI=1S/C14H18N4O3S3/c1-10-3-5-11(6-4-10)24(20,21)18-12(7-8-22-2)13(19)16-14-17-15-9-23-14/h3-6,9,12,18H,7-8H2,1-2H3,(H,16,17,19)