2-(4-bromanyl-2-methyl-phenyl)sulfanyl-N-(pyridin-3-ylmethyl)ethanamide

Systemtic Name: 2-(4-bromanyl-2-methyl-phenyl)sulfanyl-N-(pyridin-3-ylmethyl)ethanamide Openeye Name: 2-(4-bromo-2-methyl-phenyl)sulfanyl-N-(3-pyridylmethyl)acetamide CAS Name: 2-[(4-bromo-2-methylphenyl)thio]-N-(3-pyridinylmethyl)acetamide IUPAC Name: 2-(4-bromo-2-methylphenyl)sulfanyl-N-(pyridin-3-ylmethyl)acetamide Traditional Name: 2-[(4-bromo-2-methyl-phenyl)thio]-N-(3-pyridylmethyl)acetamide Formula: C15H15BrN2OS MolecularWeight: 351.2614

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)SCC(=O)NCC2=CN=CC=C2

Isomeric SMILES

CC1=C(C=CC(=C1)Br)SCC(=O)NCC2=CN=CC=C2

InChI

InChI=1S/C15H15BrN2OS/c1-11-7-13(16)4-5-14(11)20-10-15(19)18-9-12-3-2-6-17-8-12/h2-8H,9-10H2,1H3,(H,18,19)