2-[4-(2-phenylethanoylamino)phenyl]sulfanyl-N-pyridin-4-yl-propanamide

Systemtic Name: 2-[4-(2-phenylethanoylamino)phenyl]sulfanyl-N-pyridin-4-yl-propanamide Openeye Name: 2-[4-[(2-phenylacetyl)amino]phenyl]sulfanyl-N-(4-pyridyl)propanamide CAS Name: 2-[[4-[(1-oxo-2-phenylethyl)amino]phenyl]thio]-N-pyridin-4-ylpropanamide IUPAC Name: 2-[4-[(2-phenylacetyl)amino]phenyl]sulfanyl-N-pyridin-4-ylpropanamide Traditional Name: 2-[[4-[(2-phenylacetyl)amino]phenyl]thio]-N-(4-pyridyl)propionamide Formula: C22H21N3O2S MolecularWeight: 391.48604

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=NC=C1)SC2=CC=C(C=C2)NC(=O)CC3=CC=CC=C3

Isomeric SMILES

CC(C(=O)NC1=CC=NC=C1)SC2=CC=C(C=C2)NC(=O)CC3=CC=CC=C3

InChI

InChI=1S/C22H21N3O2S/c1-16(22(27)25-19-11-13-23-14-12-19)28-20-9-7-18(8-10-20)24-21(26)15-17-5-3-2-4-6-17/h2-14,16H,15H2,1H3,(H,24,26)(H,23,25,27)