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

Systemtic Name: 3,3-dimethyl-1-[(5-phenylazanyl-1,3,4-thiadiazol-2-yl)sulfanyl]butan-2-one Openeye Name: 1-[(5-anilino-1,3,4-thiadiazol-2-yl)sulfanyl]-3,3-dimethyl-butan-2-one CAS Name: 1-[(5-anilino-1,3,4-thiadiazol-2-yl)thio]-3,3-dimethyl-2-butanone IUPAC Name: 1-[(5-anilino-1,3,4-thiadiazol-2-yl)sulfanyl]-3,3-dimethylbutan-2-one Traditional Name: 1-[(5-anilino-1,3,4-thiadiazol-2-yl)thio]-3,3-dimethyl-butan-2-one Formula: C14H17N3OS2 MolecularWeight: 307.43428

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17N3OS2/c1-14(2,3)11(18)9-19-13-17-16-12(20-13)15-10-7-5-4-6-8-10/h4-8H,9H2,1-3H3,(H,15,16)