3-[(3-methylsulfanyl-1,2,4-thiadiazol-5-yl)sulfanyl]-1,3,4,5-tetrahydro-1-benzazepin-2-one

Systemtic Name: 3-[(3-methylsulfanyl-1,2,4-thiadiazol-5-yl)sulfanyl]-1,3,4,5-tetrahydro-1-benzazepin-2-one Openeye Name: 3-[(3-methylsulfanyl-1,2,4-thiadiazol-5-yl)sulfanyl]-1,3,4,5-tetrahydro-1-benzazepin-2-one CAS Name: 3-[[3-(methylthio)-1,2,4-thiadiazol-5-yl]thio]-1,3,4,5-tetrahydro-1-benzazepin-2-one IUPAC Name: 3-[(3-methylsulfanyl-1,2,4-thiadiazol-5-yl)sulfanyl]-1,3,4,5-tetrahydro-1-benzazepin-2-one Traditional Name: 3-[[3-(methylthio)-1,2,4-thiadiazol-5-yl]thio]-1,3,4,5-tetrahydro-1-benzazepin-2-one Formula: C13H13N3OS3 MolecularWeight: 323.45682

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NSC(=N1)SC2CCC3=CC=CC=C3NC2=O

Isomeric SMILES

CSC1=NSC(=N1)SC2CCC3=CC=CC=C3NC2=O

InChI

InChI=1S/C13H13N3OS3/c1-18-12-15-13(20-16-12)19-10-7-6-8-4-2-3-5-9(8)14-11(10)17/h2-5,10H,6-7H2,1H3,(H,14,17)