4-[[2-(4-bromanyl-2,5-dimethyl-phenyl)sulfanylethanoylamino]methyl]-N-methyl-N-propan-2-yl-benzamide

Systemtic Name: 4-[[2-(4-bromanyl-2,5-dimethyl-phenyl)sulfanylethanoylamino]methyl]-N-methyl-N-propan-2-yl-benzamide Openeye Name: 4-[[[2-(4-bromo-2,5-dimethyl-phenyl)sulfanylacetyl]amino]methyl]-N-isopropyl-N-methyl-benzamide CAS Name: 4-[[[2-[(4-bromo-2,5-dimethylphenyl)thio]-1-oxoethyl]amino]methyl]-N-methyl-N-propan-2-ylbenzamide IUPAC Name: 4-[[[2-(4-bromo-2,5-dimethylphenyl)sulfanylacetyl]amino]methyl]-N-methyl-N-propan-2-ylbenzamide Traditional Name: 4-[[[2-[(4-bromo-2,5-dimethyl-phenyl)thio]acetyl]amino]methyl]-N-isopropyl-N-methyl-benzamide Formula: C22H27BrN2O2S MolecularWeight: 463.43098

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Br)C)SCC(=O)NCC2=CC=C(C=C2)C(=O)N(C)C(C)C

Isomeric SMILES

CC1=CC(=C(C=C1Br)C)SCC(=O)NCC2=CC=C(C=C2)C(=O)N(C)C(C)C

InChI

InChI=1S/C22H27BrN2O2S/c1-14(2)25(5)22(27)18-8-6-17(7-9-18)12-24-21(26)13-28-20-11-15(3)19(23)10-16(20)4/h6-11,14H,12-13H2,1-5H3,(H,24,26)