3,3-dimethyl-1-[[5-[(3-methylphenyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]butan-2-one

Systemtic Name: 3,3-dimethyl-1-[[5-[(3-methylphenyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]butan-2-one Openeye Name: 3,3-dimethyl-1-[[5-(3-methylanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]butan-2-one CAS Name: 3,3-dimethyl-1-[[5-(3-methylanilino)-1,3,4-thiadiazol-2-yl]thio]-2-butanone IUPAC Name: 3,3-dimethyl-1-[[5-(3-methylanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]butan-2-one Traditional Name: 3,3-dimethyl-1-[[5-(m-toluidino)-1,3,4-thiadiazol-2-yl]thio]butan-2-one Formula: C15H19N3OS2 MolecularWeight: 321.46086

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC2=NN=C(S2)SCC(=O)C(C)(C)C

Isomeric SMILES

CC1=CC(=CC=C1)NC2=NN=C(S2)SCC(=O)C(C)(C)C

InChI

InChI=1S/C15H19N3OS2/c1-10-6-5-7-11(8-10)16-13-17-18-14(21-13)20-9-12(19)15(2,3)4/h5-8H,9H2,1-4H3,(H,16,17)