2-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)sulfanyl-N-(pyridin-3-ylmethyl)-N-(pyridin-4-ylmethyl)benzamide

Systemtic Name: 2-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)sulfanyl-N-(pyridin-3-ylmethyl)-N-(pyridin-4-ylmethyl)benzamide Openeye Name: 2-(2-oxo-2-pyrrolidin-1-yl-ethyl)sulfanyl-N-(3-pyridylmethyl)-N-(4-pyridylmethyl)benzamide CAS Name: 2-[[2-oxo-2-(1-pyrrolidinyl)ethyl]thio]-N-(3-pyridinylmethyl)-N-(pyridin-4-ylmethyl)benzamide IUPAC Name: 2-(2-oxo-2-pyrrolidin-1-ylethyl)sulfanyl-N-(pyridin-3-ylmethyl)-N-(pyridin-4-ylmethyl)benzamide Traditional Name: 2-[(2-keto-2-pyrrolidino-ethyl)thio]-N-(3-pyridylmethyl)-N-(4-pyridylmethyl)benzamide Formula: C25H26N4O2S MolecularWeight: 446.56454

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CSC2=CC=CC=C2C(=O)N(CC3=CC=NC=C3)CC4=CN=CC=C4

Isomeric SMILES

C1CCN(C1)C(=O)CSC2=CC=CC=C2C(=O)N(CC3=CC=NC=C3)CC4=CN=CC=C4

InChI

InChI=1S/C25H26N4O2S/c30-24(28-14-3-4-15-28)19-32-23-8-2-1-7-22(23)25(31)29(17-20-9-12-26-13-10-20)18-21-6-5-11-27-16-21/h1-2,5-13,16H,3-4,14-15,17-19H2