2-[(5-butylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]isoindole-1,3-dione

Systemtic Name: 2-[(5-butylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]isoindole-1,3-dione Openeye Name: 2-[(5-butylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]isoindoline-1,3-dione CAS Name: 2-[[[5-(butylthio)-1,3,4-thiadiazol-2-yl]thio]methyl]isoindole-1,3-dione IUPAC Name: 2-[(5-butylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]isoindole-1,3-dione Traditional Name: 2-[[[5-(butylthio)-1,3,4-thiadiazol-2-yl]thio]methyl]isoindoline-1,3-quinone Formula: C15H15N3O2S3 MolecularWeight: 365.4935

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=NN=C(S1)SCN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CCCCSC1=NN=C(S1)SCN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C15H15N3O2S3/c1-2-3-8-21-14-16-17-15(23-14)22-9-18-12(19)10-6-4-5-7-11(10)13(18)20/h4-7H,2-3,8-9H2,1H3