6-azanyl-1-cyclopropyl-4-oxidanylidene-7-thiomorpholin-4-yl-quinoline-3-carboxylic acid

Systemtic Name: 6-azanyl-1-cyclopropyl-4-oxidanylidene-7-thiomorpholin-4-yl-quinoline-3-carboxylic acid Openeye Name: 6-amino-1-cyclopropyl-4-oxo-7-thiomorpholino-quinoline-3-carboxylic acid CAS Name: 6-amino-1-cyclopropyl-4-oxo-7-thiomorpholin-4-yl-3-quinolinecarboxylic acid IUPAC Name: 6-amino-1-cyclopropyl-4-oxo-7-thiomorpholin-4-ylquinoline-3-carboxylic acid Traditional Name: 6-amino-1-cyclopropyl-4-keto-7-thiomorpholino-quinoline-3-carboxylic acid Formula: C17H19N3O3S MolecularWeight: 345.41606

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C=C(C(=O)C3=CC(=C(C=C32)N4CCSCC4)N)C(=O)O

Isomeric SMILES

C1CC1N2C=C(C(=O)C3=CC(=C(C=C32)N4CCSCC4)N)C(=O)O

InChI

InChI=1S/C17H19N3O3S/c18-13-7-11-14(8-15(13)19-3-5-24-6-4-19)20(10-1-2-10)9-12(16(11)21)17(22)23/h7-10H,1-6,18H2,(H,22,23)