(2S)-2-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-N-(4-ethoxyphenyl)-4-methylsulfanyl-butanamide

Systemtic Name: (2S)-2-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-N-(4-ethoxyphenyl)-4-methylsulfanyl-butanamide Openeye Name: (2S)-2-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-N-(4-ethoxyphenyl)-4-methylsulfanyl-butanamide CAS Name: (2S)-2-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-N-(4-ethoxyphenyl)-4-(methylthio)butanamide IUPAC Name: (2S)-2-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-N-(4-ethoxyphenyl)-4-methylsulfanylbutanamide Traditional Name: (2S)-4-(methylthio)-2-(piazthiol-4-ylsulfonylamino)-N-p-phenetyl-butyramide Formula: C19H22N4O4S3 MolecularWeight: 466.59738

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)C(CCSC)NS(=O)(=O)C2=CC=CC3=NSN=C32

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)[C@H](CCSC)NS(=O)(=O)C2=CC=CC3=NSN=C32

InChI

InChI=1S/C19H22N4O4S3/c1-3-27-14-9-7-13(8-10-14)20-19(24)16(11-12-28-2)23-30(25,26)17-6-4-5-15-18(17)22-29-21-15/h4-10,16,23H,3,11-12H2,1-2H3,(H,20,24)/t16-/m0/s1