N-[(5-acetamido-1,3,4-thiadiazol-2-yl)sulfonyl]-6-[(5-bromanyl-2-prop-2-enoxy-phenyl)methyl-ethyl-amino]pyridazine-3-carboxamide

Systemtic Name: N-[(5-acetamido-1,3,4-thiadiazol-2-yl)sulfonyl]-6-[(5-bromanyl-2-prop-2-enoxy-phenyl)methyl-ethyl-amino]pyridazine-3-carboxamide Openeye Name: N-[(5-acetamido-1,3,4-thiadiazol-2-yl)sulfonyl]-6-[(2-allyloxy-5-bromo-phenyl)methyl-ethyl-amino]pyridazine-3-carboxamide CAS Name: N-[(5-acetamido-1,3,4-thiadiazol-2-yl)sulfonyl]-6-[(5-bromo-2-prop-2-enoxyphenyl)methyl-ethylamino]-3-pyridazinecarboxamide IUPAC Name: N-[(5-acetamido-1,3,4-thiadiazol-2-yl)sulfonyl]-6-[(5-bromo-2-prop-2-enoxyphenyl)methyl-ethylamino]pyridazine-3-carboxamide Traditional Name: N-[(5-acetamido-1,3,4-thiadiazol-2-yl)sulfonyl]-6-[(2-allyloxy-5-bromo-benzyl)-ethyl-amino]pyridazine-3-carboxamide Formula: C21H22BrN7O5S2 MolecularWeight: 596.47728

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=C(C=CC(=C1)Br)OCC=C)C2=NN=C(C=C2)C(=O)NS(=O)(=O)C3=NN=C(S3)NC(=O)C

Isomeric SMILES

CCN(CC1=C(C=CC(=C1)Br)OCC=C)C2=NN=C(C=C2)C(=O)NS(=O)(=O)C3=NN=C(S3)NC(=O)C

InChI

InChI=1S/C21H22BrN7O5S2/c1-4-10-34-17-8-6-15(22)11-14(17)12-29(5-2)18-9-7-16(24-25-18)19(31)28-36(32,33)21-27-26-20(35-21)23-13(3)30/h4,6-9,11H,1,5,10,12H2,2-3H3,(H,28,31)(H,23,26,30)