N-(2-bromanyl-4-methyl-phenyl)-1-(4-methylsulfanylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: N-(2-bromanyl-4-methyl-phenyl)-1-(4-methylsulfanylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: N-(2-bromo-4-methyl-phenyl)-1-(4-methylsulfanylphenyl)-5-oxo-pyrrolidine-3-carboxamide CAS Name: N-(2-bromo-4-methylphenyl)-1-[4-(methylthio)phenyl]-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: N-(2-bromo-4-methylphenyl)-1-(4-methylsulfanylphenyl)-5-oxopyrrolidine-3-carboxamide Traditional Name: N-(2-bromo-4-methyl-phenyl)-5-keto-1-[4-(methylthio)phenyl]pyrrolidine-3-carboxamide Formula: C19H19BrN2O2S MolecularWeight: 419.33536

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C2CC(=O)N(C2)C3=CC=C(C=C3)SC)Br

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C2CC(=O)N(C2)C3=CC=C(C=C3)SC)Br

InChI

InChI=1S/C19H19BrN2O2S/c1-12-3-8-17(16(20)9-12)21-19(24)13-10-18(23)22(11-13)14-4-6-15(25-2)7-5-14/h3-9,13H,10-11H2,1-2H3,(H,21,24)