N-[1-(3-bromanyl-4-methoxy-phenyl)ethyl]-4-[(2-methyl-1,3-thiazol-4-yl)methylsulfanyl]benzamide

Systemtic Name: N-[1-(3-bromanyl-4-methoxy-phenyl)ethyl]-4-[(2-methyl-1,3-thiazol-4-yl)methylsulfanyl]benzamide Openeye Name: N-[1-(3-bromo-4-methoxy-phenyl)ethyl]-4-[(2-methylthiazol-4-yl)methylsulfanyl]benzamide CAS Name: N-[1-(3-bromo-4-methoxyphenyl)ethyl]-4-[(2-methyl-4-thiazolyl)methylthio]benzamide IUPAC Name: N-[1-(3-bromo-4-methoxyphenyl)ethyl]-4-[(2-methyl-1,3-thiazol-4-yl)methylsulfanyl]benzamide Traditional Name: N-[1-(3-bromo-4-methoxy-phenyl)ethyl]-4-[(2-methylthiazol-4-yl)methylthio]benzamide Formula: C21H21BrN2O2S2 MolecularWeight: 477.43764

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)CSC2=CC=C(C=C2)C(=O)NC(C)C3=CC(=C(C=C3)OC)Br

Isomeric SMILES

CC1=NC(=CS1)CSC2=CC=C(C=C2)C(=O)NC(C)C3=CC(=C(C=C3)OC)Br

InChI

InChI=1S/C21H21BrN2O2S2/c1-13(16-6-9-20(26-3)19(22)10-16)23-21(25)15-4-7-18(8-5-15)28-12-17-11-27-14(2)24-17/h4-11,13H,12H2,1-3H3,(H,23,25)