ethyl N-[(2-bromanyl-5-pyrrolidin-1-ylsulfonyl-phenyl)carbonylamino]carbamate

Systemtic Name: ethyl N-[(2-bromanyl-5-pyrrolidin-1-ylsulfonyl-phenyl)carbonylamino]carbamate Openeye Name: ethyl N-[(2-bromo-5-pyrrolidin-1-ylsulfonyl-benzoyl)amino]carbamate CAS Name: N-[[[2-bromo-5-(1-pyrrolidinylsulfonyl)phenyl]-oxomethyl]amino]carbamic acid ethyl ester IUPAC Name: ethyl N-[(2-bromo-5-pyrrolidin-1-ylsulfonylbenzoyl)amino]carbamate Traditional Name: N-[(2-bromo-5-pyrrolidinosulfonyl-benzoyl)amino]carbamic acid ethyl ester Formula: C14H18BrN3O5S MolecularWeight: 420.27882

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NNC(=O)C1=C(C=CC(=C1)S(=O)(=O)N2CCCC2)Br

Isomeric SMILES

CCOC(=O)NNC(=O)C1=C(C=CC(=C1)S(=O)(=O)N2CCCC2)Br

InChI

InChI=1S/C14H18BrN3O5S/c1-2-23-14(20)17-16-13(19)11-9-10(5-6-12(11)15)24(21,22)18-7-3-4-8-18/h5-6,9H,2-4,7-8H2,1H3,(H,16,19)(H,17,20)