3-[(3-cyano-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]-N-(4-sulfamoylphenyl)propanamide

Systemtic Name: 3-[(3-cyano-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]-N-(4-sulfamoylphenyl)propanamide Openeye Name: 3-[(3-cyano-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]-N-(4-sulfamoylphenyl)propanamide CAS Name: 3-[(3-cyano-5,6,7,8-tetrahydroquinolin-2-yl)thio]-N-(4-sulfamoylphenyl)propanamide IUPAC Name: 3-[(3-cyano-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]-N-(4-sulfamoylphenyl)propanamide Traditional Name: 3-[(3-cyano-5,6,7,8-tetrahydroquinolin-2-yl)thio]-N-(4-sulfamoylphenyl)propionamide Formula: C19H20N4O3S2 MolecularWeight: 416.5171

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C=C(C(=N2)SCCC(=O)NC3=CC=C(C=C3)S(=O)(=O)N)C#N

Isomeric SMILES

C1CCC2=C(C1)C=C(C(=N2)SCCC(=O)NC3=CC=C(C=C3)S(=O)(=O)N)C#N

InChI

InChI=1S/C19H20N4O3S2/c20-12-14-11-13-3-1-2-4-17(13)23-19(14)27-10-9-18(24)22-15-5-7-16(8-6-15)28(21,25)26/h5-8,11H,1-4,9-10H2,(H,22,24)(H2,21,25,26)