4-[2-(4-bromanyl-2-methyl-phenyl)sulfanylethanoyl]-N-methyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide

Systemtic Name: 4-[2-(4-bromanyl-2-methyl-phenyl)sulfanylethanoyl]-N-methyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Openeye Name: 4-[2-(4-bromo-2-methyl-phenyl)sulfanylacetyl]-N-methyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide CAS Name: 4-[2-[(4-bromo-2-methylphenyl)thio]-1-oxoethyl]-N-methyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide IUPAC Name: 4-[2-(4-bromo-2-methylphenyl)sulfanylacetyl]-N-methyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Traditional Name: 4-[2-[(4-bromo-2-methyl-phenyl)thio]acetyl]-N-methyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Formula: C19H19BrN2O3S MolecularWeight: 435.33476

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)SCC(=O)N2CC(OC3=CC=CC=C32)C(=O)NC

Isomeric SMILES

CC1=C(C=CC(=C1)Br)SCC(=O)N2CC(OC3=CC=CC=C32)C(=O)NC

InChI

InChI=1S/C19H19BrN2O3S/c1-12-9-13(20)7-8-17(12)26-11-18(23)22-10-16(19(24)21-2)25-15-6-4-3-5-14(15)22/h3-9,16H,10-11H2,1-2H3,(H,21,24)