5-bromanyl-2-[(2-ethyl-4-iodanyl-phenyl)amino]-N-(2-pyrrolidin-1-ylethyl)benzamide

Systemtic Name: 5-bromanyl-2-[(2-ethyl-4-iodanyl-phenyl)amino]-N-(2-pyrrolidin-1-ylethyl)benzamide Openeye Name: 5-bromo-2-(2-ethyl-4-iodo-anilino)-N-(2-pyrrolidin-1-ylethyl)benzamide CAS Name: 5-bromo-2-(2-ethyl-4-iodoanilino)-N-[2-(1-pyrrolidinyl)ethyl]benzamide IUPAC Name: 5-bromo-2-(2-ethyl-4-iodoanilino)-N-(2-pyrrolidin-1-ylethyl)benzamide Traditional Name: 5-bromo-2-(2-ethyl-4-iodo-anilino)-N-(2-pyrrolidinoethyl)benzamide Formula: C21H25BrIN3O MolecularWeight: 542.25117

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)I)NC2=C(C=C(C=C2)Br)C(=O)NCCN3CCCC3

Isomeric SMILES

CCC1=C(C=CC(=C1)I)NC2=C(C=C(C=C2)Br)C(=O)NCCN3CCCC3

InChI

InChI=1S/C21H25BrIN3O/c1-2-15-13-17(23)6-8-19(15)25-20-7-5-16(22)14-18(20)21(27)24-9-12-26-10-3-4-11-26/h5-8,13-14,25H,2-4,9-12H2,1H3,(H,24,27)