(2S)-2-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-N-(1,3-thiazol-4-ylmethyl)propanamide

Systemtic Name: (2S)-2-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-N-(1,3-thiazol-4-ylmethyl)propanamide Openeye Name: (2S)-2-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-N-(thiazol-4-ylmethyl)propanamide CAS Name: (2S)-2-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-N-(4-thiazolylmethyl)propanamide IUPAC Name: (2S)-2-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-N-(1,3-thiazol-4-ylmethyl)propanamide Traditional Name: (2S)-2-(piazthiol-4-ylsulfonylamino)-N-(thiazol-4-ylmethyl)propionamide Formula: C13H13N5O3S3 MolecularWeight: 383.46902

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CSC=N1)NS(=O)(=O)C2=CC=CC3=NSN=C32

Isomeric SMILES

C[C@@H](C(=O)NCC1=CSC=N1)NS(=O)(=O)C2=CC=CC3=NSN=C32

InChI

InChI=1S/C13H13N5O3S3/c1-8(13(19)14-5-9-6-22-7-15-9)18-24(20,21)11-4-2-3-10-12(11)17-23-16-10/h2-4,6-8,18H,5H2,1H3,(H,14,19)/t8-/m0/s1