N-[(2S)-1-[(2-methylsulfanyl-1,3-benzothiazol-6-yl)amino]-1-oxidanylidene-3-phenyl-propan-2-yl]furan-2-carboxamide

Systemtic Name: N-[(2S)-1-[(2-methylsulfanyl-1,3-benzothiazol-6-yl)amino]-1-oxidanylidene-3-phenyl-propan-2-yl]furan-2-carboxamide Openeye Name: N-[(1S)-1-benzyl-2-[(2-methylsulfanyl-1,3-benzothiazol-6-yl)amino]-2-oxo-ethyl]furan-2-carboxamide CAS Name: N-[(2S)-1-[[2-(methylthio)-1,3-benzothiazol-6-yl]amino]-1-oxo-3-phenylpropan-2-yl]-2-furancarboxamide IUPAC Name: N-[(2S)-1-[(2-methylsulfanyl-1,3-benzothiazol-6-yl)amino]-1-oxo-3-phenylpropan-2-yl]furan-2-carboxamide Traditional Name: N-[(1S)-1-benzyl-2-keto-2-[[2-(methylthio)-1,3-benzothiazol-6-yl]amino]ethyl]-2-furamide Formula: C22H19N3O3S2 MolecularWeight: 437.53456

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC2=C(S1)C=C(C=C2)NC(=O)C(CC3=CC=CC=C3)NC(=O)C4=CC=CO4

Isomeric SMILES

CSC1=NC2=C(S1)C=C(C=C2)NC(=O)[C@H](CC3=CC=CC=C3)NC(=O)C4=CC=CO4

InChI

InChI=1S/C22H19N3O3S2/c1-29-22-25-16-10-9-15(13-19(16)30-22)23-20(26)17(12-14-6-3-2-4-7-14)24-21(27)18-8-5-11-28-18/h2-11,13,17H,12H2,1H3,(H,23,26)(H,24,27)/t17-/m0/s1