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

Systemtic Name: N-[(2S)-1-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-1-oxidanylidene-3-phenyl-propan-2-yl]furan-2-carboxamide Openeye Name: N-[(1S)-2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-1-benzyl-2-oxo-ethyl]furan-2-carboxamide CAS Name: N-[(2S)-1-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-1-oxo-3-phenylpropan-2-yl]-2-furancarboxamide IUPAC Name: N-[(2S)-1-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-1-oxo-3-phenylpropan-2-yl]furan-2-carboxamide Traditional Name: N-[(1S)-2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-1-benzyl-2-keto-ethyl]-2-furamide Formula: C23H21N3O3S MolecularWeight: 419.49614

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=NC2=CC=CC=C2S1)C(=O)C(CC3=CC=CC=C3)NC(=O)C4=CC=CO4

Isomeric SMILES

CN(CC1=NC2=CC=CC=C2S1)C(=O)[C@H](CC3=CC=CC=C3)NC(=O)C4=CC=CO4

InChI

InChI=1S/C23H21N3O3S/c1-26(15-21-24-17-10-5-6-12-20(17)30-21)23(28)18(14-16-8-3-2-4-9-16)25-22(27)19-11-7-13-29-19/h2-13,18H,14-15H2,1H3,(H,25,27)/t18-/m0/s1