N-[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-2-chloranyl-N-methyl-5-methylsulfanyl-benzamide

Systemtic Name: N-[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-2-chloranyl-N-methyl-5-methylsulfanyl-benzamide Openeye Name: N-[2-(4-bromo-2-methyl-anilino)-2-oxo-ethyl]-2-chloro-N-methyl-5-methylsulfanyl-benzamide CAS Name: N-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-2-chloro-N-methyl-5-(methylthio)benzamide IUPAC Name: N-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-2-chloro-N-methyl-5-methylsulfanylbenzamide Traditional Name: N-[2-(4-bromo-2-methyl-anilino)-2-keto-ethyl]-2-chloro-N-methyl-5-(methylthio)benzamide Formula: C18H18BrClN2O2S MolecularWeight: 441.76972

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)CN(C)C(=O)C2=C(C=CC(=C2)SC)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)CN(C)C(=O)C2=C(C=CC(=C2)SC)Cl

InChI

InChI=1S/C18H18BrClN2O2S/c1-11-8-12(19)4-7-16(11)21-17(23)10-22(2)18(24)14-9-13(25-3)5-6-15(14)20/h4-9H,10H2,1-3H3,(H,21,23)