1-cyclopropyl-6,7,8-tris(methylsulfanyl)-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-cyclopropyl-6,7,8-tris(methylsulfanyl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-6,7,8-tris(methylsulfanyl)-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-6,7,8-tris(methylthio)-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-6,7,8-tris(methylsulfanyl)-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-4-keto-6,7,8-tris(methylthio)quinoline-3-carboxylic acid Formula: C16H17NO3S3 MolecularWeight: 367.50608

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C(=C2C(=C1)C(=O)C(=CN2C3CC3)C(=O)O)SC)SC

Isomeric SMILES

CSC1=C(C(=C2C(=C1)C(=O)C(=CN2C3CC3)C(=O)O)SC)SC

InChI

InChI=1S/C16H17NO3S3/c1-21-11-6-9-12(15(23-3)14(11)22-2)17(8-4-5-8)7-10(13(9)18)16(19)20/h6-8H,4-5H2,1-3H3,(H,19,20)