1-(4-bromanyl-3-methyl-phenyl)-N-[2-methyl-5-(methylcarbamoyl)phenyl]-5-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: 1-(4-bromanyl-3-methyl-phenyl)-N-[2-methyl-5-(methylcarbamoyl)phenyl]-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: 1-(4-bromo-3-methyl-phenyl)-N-[2-methyl-5-(methylcarbamoyl)phenyl]-5-oxo-pyrrolidine-3-carboxamide CAS Name: 1-(4-bromo-3-methylphenyl)-N-[2-methyl-5-(methylcarbamoyl)phenyl]-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: 1-(4-bromo-3-methylphenyl)-N-[2-methyl-5-(methylcarbamoyl)phenyl]-5-oxopyrrolidine-3-carboxamide Traditional Name: 1-(4-bromo-3-methyl-phenyl)-5-keto-N-[2-methyl-5-(methylcarbamoyl)phenyl]pyrrolidine-3-carboxamide Formula: C21H22BrN3O3 MolecularWeight: 444.32168

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22BrN3O3/c1-12-4-5-14(20(27)23-3)9-18(12)24-21(28)15-10-19(26)25(11-15)16-6-7-17(22)13(2)8-16/h4-9,15H,10-11H2,1-3H3,(H,23,27)(H,24,28)