3,3-dimethyl-N-[4-[2-oxidanylidene-1-phenyl-2-(pyridin-4-ylamino)ethyl]sulfanylphenyl]butanamide

Systemtic Name: 3,3-dimethyl-N-[4-[2-oxidanylidene-1-phenyl-2-(pyridin-4-ylamino)ethyl]sulfanylphenyl]butanamide Openeye Name: 3,3-dimethyl-N-[4-[2-oxo-1-phenyl-2-(4-pyridylamino)ethyl]sulfanylphenyl]butanamide CAS Name: 3,3-dimethyl-N-[4-[[2-oxo-1-phenyl-2-(pyridin-4-ylamino)ethyl]thio]phenyl]butanamide IUPAC Name: 3,3-dimethyl-N-[4-[2-oxo-1-phenyl-2-(pyridin-4-ylamino)ethyl]sulfanylphenyl]butanamide Traditional Name: N-[4-[[2-keto-1-phenyl-2-(4-pyridylamino)ethyl]thio]phenyl]-3,3-dimethyl-butyramide Formula: C25H27N3O2S MolecularWeight: 433.56578

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(=O)NC1=CC=C(C=C1)SC(C2=CC=CC=C2)C(=O)NC3=CC=NC=C3

Isomeric SMILES

CC(C)(C)CC(=O)NC1=CC=C(C=C1)SC(C2=CC=CC=C2)C(=O)NC3=CC=NC=C3

InChI

InChI=1S/C25H27N3O2S/c1-25(2,3)17-22(29)27-19-9-11-21(12-10-19)31-23(18-7-5-4-6-8-18)24(30)28-20-13-15-26-16-14-20/h4-16,23H,17H2,1-3H3,(H,27,29)(H,26,28,30)