N-[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-4-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]benzamide

Systemtic Name: N-[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-4-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]benzamide Openeye Name: N-[2-(4-bromo-2-methyl-anilino)-2-oxo-ethyl]-4-[(4-methylthiazol-2-yl)sulfanylmethyl]benzamide CAS Name: N-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-4-[[(4-methyl-2-thiazolyl)thio]methyl]benzamide IUPAC Name: N-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-4-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]benzamide Traditional Name: N-[2-(4-bromo-2-methyl-anilino)-2-keto-ethyl]-4-[[(4-methylthiazol-2-yl)thio]methyl]benzamide Formula: C21H20BrN3O2S2 MolecularWeight: 490.4364

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)CNC(=O)C2=CC=C(C=C2)CSC3=NC(=CS3)C

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)CNC(=O)C2=CC=C(C=C2)CSC3=NC(=CS3)C

InChI

InChI=1S/C21H20BrN3O2S2/c1-13-9-17(22)7-8-18(13)25-19(26)10-23-20(27)16-5-3-15(4-6-16)12-29-21-24-14(2)11-28-21/h3-9,11H,10,12H2,1-2H3,(H,23,27)(H,25,26)