2-[2-(dimethylamino)-2-oxidanylidene-ethyl]sulfanyl-N-[4-(pyridin-4-ylmethyl)phenyl]benzamide

Systemtic Name: 2-[2-(dimethylamino)-2-oxidanylidene-ethyl]sulfanyl-N-[4-(pyridin-4-ylmethyl)phenyl]benzamide Openeye Name: 2-[2-(dimethylamino)-2-oxo-ethyl]sulfanyl-N-[4-(4-pyridylmethyl)phenyl]benzamide CAS Name: 2-[[2-(dimethylamino)-2-oxoethyl]thio]-N-[4-(pyridin-4-ylmethyl)phenyl]benzamide IUPAC Name: 2-[2-(dimethylamino)-2-oxoethyl]sulfanyl-N-[4-(pyridin-4-ylmethyl)phenyl]benzamide Traditional Name: 2-[[2-(dimethylamino)-2-keto-ethyl]thio]-N-[4-(4-pyridylmethyl)phenyl]benzamide Formula: C23H23N3O2S MolecularWeight: 405.51262

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)CSC1=CC=CC=C1C(=O)NC2=CC=C(C=C2)CC3=CC=NC=C3

Isomeric SMILES

CN(C)C(=O)CSC1=CC=CC=C1C(=O)NC2=CC=C(C=C2)CC3=CC=NC=C3

InChI

InChI=1S/C23H23N3O2S/c1-26(2)22(27)16-29-21-6-4-3-5-20(21)23(28)25-19-9-7-17(8-10-19)15-18-11-13-24-14-12-18/h3-14H,15-16H2,1-2H3,(H,25,28)