4-(1,3-benzothiazol-2-ylsulfanylmethyl)-N-(4-pyrrolidin-1-ylcarbonylphenyl)benzamide

Systemtic Name: 4-(1,3-benzothiazol-2-ylsulfanylmethyl)-N-(4-pyrrolidin-1-ylcarbonylphenyl)benzamide Openeye Name: 4-(1,3-benzothiazol-2-ylsulfanylmethyl)-N-[4-(pyrrolidine-1-carbonyl)phenyl]benzamide CAS Name: 4-[(1,3-benzothiazol-2-ylthio)methyl]-N-[4-[oxo(1-pyrrolidinyl)methyl]phenyl]benzamide IUPAC Name: 4-(1,3-benzothiazol-2-ylsulfanylmethyl)-N-[4-(pyrrolidine-1-carbonyl)phenyl]benzamide Traditional Name: 4-[(1,3-benzothiazol-2-ylthio)methyl]-N-[4-(pyrrolidine-1-carbonyl)phenyl]benzamide Formula: C26H23N3O2S2 MolecularWeight: 473.60972

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)CSC4=NC5=CC=CC=C5S4

Isomeric SMILES

C1CCN(C1)C(=O)C2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)CSC4=NC5=CC=CC=C5S4

InChI

InChI=1S/C26H23N3O2S2/c30-24(27-21-13-11-20(12-14-21)25(31)29-15-3-4-16-29)19-9-7-18(8-10-19)17-32-26-28-22-5-1-2-6-23(22)33-26/h1-2,5-14H,3-4,15-17H2,(H,27,30)