3-[(2-oxidanylidenepyrrolidin-1-yl)methyl]-N-(6-phenoxy-1,3-benzothiazol-2-yl)benzamide

Systemtic Name: 3-[(2-oxidanylidenepyrrolidin-1-yl)methyl]-N-(6-phenoxy-1,3-benzothiazol-2-yl)benzamide Openeye Name: 3-[(2-oxopyrrolidin-1-yl)methyl]-N-(6-phenoxy-1,3-benzothiazol-2-yl)benzamide CAS Name: 3-[(2-oxo-1-pyrrolidinyl)methyl]-N-(6-phenoxy-1,3-benzothiazol-2-yl)benzamide IUPAC Name: 3-[(2-oxopyrrolidin-1-yl)methyl]-N-(6-phenoxy-1,3-benzothiazol-2-yl)benzamide Traditional Name: 3-[(2-ketopyrrolidino)methyl]-N-(6-phenoxy-1,3-benzothiazol-2-yl)benzamide Formula: C25H21N3O3S MolecularWeight: 443.51754

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)CC2=CC=CC(=C2)C(=O)NC3=NC4=C(S3)C=C(C=C4)OC5=CC=CC=C5

Isomeric SMILES

C1CC(=O)N(C1)CC2=CC=CC(=C2)C(=O)NC3=NC4=C(S3)C=C(C=C4)OC5=CC=CC=C5

InChI

InChI=1S/C25H21N3O3S/c29-23-10-5-13-28(23)16-17-6-4-7-18(14-17)24(30)27-25-26-21-12-11-20(15-22(21)32-25)31-19-8-2-1-3-9-19/h1-4,6-9,11-12,14-15H,5,10,13,16H2,(H,26,27,30)