2-acetamido-3-methyl-N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]butanamide

Systemtic Name: 2-acetamido-3-methyl-N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]butanamide Openeye Name: 2-acetamido-3-methyl-N-[4-(3-pyridylmethylsulfanyl)phenyl]butanamide CAS Name: 2-acetamido-3-methyl-N-[4-(3-pyridinylmethylthio)phenyl]butanamide IUPAC Name: 2-acetamido-3-methyl-N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]butanamide Traditional Name: 2-acetamido-3-methyl-N-[4-(3-pyridylmethylthio)phenyl]butyramide Formula: C19H23N3O2S MolecularWeight: 357.46982

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1=CC=C(C=C1)SCC2=CN=CC=C2)NC(=O)C

Isomeric SMILES

CC(C)C(C(=O)NC1=CC=C(C=C1)SCC2=CN=CC=C2)NC(=O)C

InChI

InChI=1S/C19H23N3O2S/c1-13(2)18(21-14(3)23)19(24)22-16-6-8-17(9-7-16)25-12-15-5-4-10-20-11-15/h4-11,13,18H,12H2,1-3H3,(H,21,23)(H,22,24)