1-thiophen-2-ylcarbonyl-N-[2-(2-thiophen-3-ylethylsulfanyl)-1,3-benzothiazol-6-yl]pyrrolidine-2-carboxamide

Systemtic Name: 1-thiophen-2-ylcarbonyl-N-[2-(2-thiophen-3-ylethylsulfanyl)-1,3-benzothiazol-6-yl]pyrrolidine-2-carboxamide Openeye Name: N-[2-[2-(3-thienyl)ethylsulfanyl]-1,3-benzothiazol-6-yl]-1-(thiophene-2-carbonyl)pyrrolidine-2-carboxamide CAS Name: 1-[oxo(thiophen-2-yl)methyl]-N-[2-[2-(3-thiophenyl)ethylthio]-1,3-benzothiazol-6-yl]-2-pyrrolidinecarboxamide IUPAC Name: 1-(thiophene-2-carbonyl)-N-[2-(2-thiophen-3-ylethylsulfanyl)-1,3-benzothiazol-6-yl]pyrrolidine-2-carboxamide Traditional Name: 1-(2-thenoyl)-N-[2-[2-(3-thienyl)ethylthio]-1,3-benzothiazol-6-yl]pyrrolidine-2-carboxamide Formula: C23H21N3O2S4 MolecularWeight: 499.69174

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C2=CC=CS2)C(=O)NC3=CC4=C(C=C3)N=C(S4)SCCC5=CSC=C5

Isomeric SMILES

C1CC(N(C1)C(=O)C2=CC=CS2)C(=O)NC3=CC4=C(C=C3)N=C(S4)SCCC5=CSC=C5

InChI

InChI=1S/C23H21N3O2S4/c27-21(18-3-1-9-26(18)22(28)19-4-2-10-30-19)24-16-5-6-17-20(13-16)32-23(25-17)31-12-8-15-7-11-29-14-15/h2,4-7,10-11,13-14,18H,1,3,8-9,12H2,(H,24,27)