(3S)-1-(furan-2-ylmethyl)-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)-5-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: (3S)-1-(furan-2-ylmethyl)-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: (3S)-1-(2-furylmethyl)-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)-5-oxo-pyrrolidine-3-carboxamide CAS Name: (3S)-1-(2-furanylmethyl)-N-[2-(methylthio)-1,3-benzothiazol-6-yl]-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: (3S)-1-(furan-2-ylmethyl)-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)-5-oxopyrrolidine-3-carboxamide Traditional Name: (3S)-1-(2-furfuryl)-5-keto-N-[2-(methylthio)-1,3-benzothiazol-6-yl]pyrrolidine-3-carboxamide Formula: C18H17N3O3S2 MolecularWeight: 387.47588

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC2=C(S1)C=C(C=C2)NC(=O)C3CC(=O)N(C3)CC4=CC=CO4

Isomeric SMILES

CSC1=NC2=C(S1)C=C(C=C2)NC(=O)[C@H]3CC(=O)N(C3)CC4=CC=CO4

InChI

InChI=1S/C18H17N3O3S2/c1-25-18-20-14-5-4-12(8-15(14)26-18)19-17(23)11-7-16(22)21(9-11)10-13-3-2-6-24-13/h2-6,8,11H,7,9-10H2,1H3,(H,19,23)/t11-/m0/s1