2-[4-(5-bromanyl-2-methoxy-phenyl)sulfonylpiperazin-1-yl]-N-cyclopropyl-2-oxidanylidene-ethanamide

Systemtic Name: 2-[4-(5-bromanyl-2-methoxy-phenyl)sulfonylpiperazin-1-yl]-N-cyclopropyl-2-oxidanylidene-ethanamide Openeye Name: 2-[4-(5-bromo-2-methoxy-phenyl)sulfonylpiperazin-1-yl]-N-cyclopropyl-2-oxo-acetamide CAS Name: 2-[4-(5-bromo-2-methoxyphenyl)sulfonyl-1-piperazinyl]-N-cyclopropyl-2-oxoacetamide IUPAC Name: 2-[4-(5-bromo-2-methoxyphenyl)sulfonylpiperazin-1-yl]-N-cyclopropyl-2-oxoacetamide Traditional Name: 2-[4-(5-bromo-2-methoxy-phenyl)sulfonylpiperazino]-N-cyclopropyl-2-keto-acetamide Formula: C16H20BrN3O5S MolecularWeight: 446.3161

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)S(=O)(=O)N2CCN(CC2)C(=O)C(=O)NC3CC3

Isomeric SMILES

COC1=C(C=C(C=C1)Br)S(=O)(=O)N2CCN(CC2)C(=O)C(=O)NC3CC3

InChI

InChI=1S/C16H20BrN3O5S/c1-25-13-5-2-11(17)10-14(13)26(23,24)20-8-6-19(7-9-20)16(22)15(21)18-12-3-4-12/h2,5,10,12H,3-4,6-9H2,1H3,(H,18,21)