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

Systemtic Name: 1-[[5-[(4-methoxyphenyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]-3,3-dimethyl-butan-2-one Openeye Name: 1-[[5-(4-methoxyanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]-3,3-dimethyl-butan-2-one CAS Name: 1-[[5-(4-methoxyanilino)-1,3,4-thiadiazol-2-yl]thio]-3,3-dimethyl-2-butanone IUPAC Name: 1-[[5-(4-methoxyanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]-3,3-dimethylbutan-2-one Traditional Name: 3,3-dimethyl-1-[[5-(p-anisidino)-1,3,4-thiadiazol-2-yl]thio]butan-2-one Formula: C15H19N3O2S2 MolecularWeight: 337.46026

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)CSC1=NN=C(S1)NC2=CC=C(C=C2)OC

Isomeric SMILES

CC(C)(C)C(=O)CSC1=NN=C(S1)NC2=CC=C(C=C2)OC

InChI

InChI=1S/C15H19N3O2S2/c1-15(2,3)12(19)9-21-14-18-17-13(22-14)16-10-5-7-11(20-4)8-6-10/h5-8H,9H2,1-4H3,(H,16,17)