ethyl 4-[3-[(2-azanyl-5-bromanyl-pyridin-3-yl)sulfonylamino]propanoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[3-[(2-azanyl-5-bromanyl-pyridin-3-yl)sulfonylamino]propanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[3-[(2-amino-5-bromo-3-pyridyl)sulfonylamino]propanoyl]piperazine-1-carboxylate CAS Name: 4-[3-[(2-amino-5-bromo-3-pyridinyl)sulfonylamino]-1-oxopropyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[3-[(2-amino-5-bromopyridin-3-yl)sulfonylamino]propanoyl]piperazine-1-carboxylate Traditional Name: 4-[3-[(2-amino-5-bromo-3-pyridyl)sulfonylamino]propanoyl]piperazine-1-carboxylic acid ethyl ester Formula: C15H22BrN5O5S MolecularWeight: 464.33468

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)CCNS(=O)(=O)C2=CC(=CN=C2N)Br

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)CCNS(=O)(=O)C2=CC(=CN=C2N)Br

InChI

InChI=1S/C15H22BrN5O5S/c1-2-26-15(23)21-7-5-20(6-8-21)13(22)3-4-19-27(24,25)12-9-11(16)10-18-14(12)17/h9-10,19H,2-8H2,1H3,(H2,17,18)