5-oxidanylidene-N-[2-oxidanylidene-2-[[2-(2-propan-2-ylsulfanylethylsulfanyl)-1,3-benzothiazol-6-yl]amino]ethyl]pyrrolidine-2-carboxamide

Systemtic Name: 5-oxidanylidene-N-[2-oxidanylidene-2-[[2-(2-propan-2-ylsulfanylethylsulfanyl)-1,3-benzothiazol-6-yl]amino]ethyl]pyrrolidine-2-carboxamide Openeye Name: N-[2-[[2-(2-isopropylsulfanylethylsulfanyl)-1,3-benzothiazol-6-yl]amino]-2-oxo-ethyl]-5-oxo-pyrrolidine-2-carboxamide CAS Name: 5-oxo-N-[2-oxo-2-[[2-[2-(propan-2-ylthio)ethylthio]-1,3-benzothiazol-6-yl]amino]ethyl]-2-pyrrolidinecarboxamide IUPAC Name: 5-oxo-N-[2-oxo-2-[[2-(2-propan-2-ylsulfanylethylsulfanyl)-1,3-benzothiazol-6-yl]amino]ethyl]pyrrolidine-2-carboxamide Traditional Name: N-[2-[[2-[2-(isopropylthio)ethylthio]-1,3-benzothiazol-6-yl]amino]-2-keto-ethyl]-5-keto-pyrrolidine-2-carboxamide Formula: C19H24N4O3S3 MolecularWeight: 452.61386

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SCCSC1=NC2=C(S1)C=C(C=C2)NC(=O)CNC(=O)C3CCC(=O)N3

Isomeric SMILES

CC(C)SCCSC1=NC2=C(S1)C=C(C=C2)NC(=O)CNC(=O)C3CCC(=O)N3

InChI

InChI=1S/C19H24N4O3S3/c1-11(2)27-7-8-28-19-23-13-4-3-12(9-15(13)29-19)21-17(25)10-20-18(26)14-5-6-16(24)22-14/h3-4,9,11,14H,5-8,10H2,1-2H3,(H,20,26)(H,21,25)(H,22,24)