(2S)-N-[2-(1,3-benzothiazol-2-ylamino)-2-oxidanylidene-ethyl]-3-phenyl-2-(phenylsulfonylamino)propanamide

Systemtic Name: (2S)-N-[2-(1,3-benzothiazol-2-ylamino)-2-oxidanylidene-ethyl]-3-phenyl-2-(phenylsulfonylamino)propanamide Openeye Name: (2S)-2-(benzenesulfonamido)-N-[2-(1,3-benzothiazol-2-ylamino)-2-oxo-ethyl]-3-phenyl-propanamide CAS Name: (2S)-2-(benzenesulfonamido)-N-[2-(1,3-benzothiazol-2-ylamino)-2-oxoethyl]-3-phenylpropanamide IUPAC Name: (2S)-2-(benzenesulfonamido)-N-[2-(1,3-benzothiazol-2-ylamino)-2-oxoethyl]-3-phenylpropanamide Traditional Name: (2S)-2-(benzenesulfonamido)-N-[2-(1,3-benzothiazol-2-ylamino)-2-keto-ethyl]-3-phenyl-propionamide Formula: C24H22N4O4S2 MolecularWeight: 494.58588

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)NCC(=O)NC2=NC3=CC=CC=C3S2)NS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](C(=O)NCC(=O)NC2=NC3=CC=CC=C3S2)NS(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C24H22N4O4S2/c29-22(27-24-26-19-13-7-8-14-21(19)33-24)16-25-23(30)20(15-17-9-3-1-4-10-17)28-34(31,32)18-11-5-2-6-12-18/h1-14,20,28H,15-16H2,(H,25,30)(H,26,27,29)/t20-/m0/s1