6-[(5-bromanyl-2-phenylmethoxy-phenyl)methyl-ethyl-amino]-N-(phenylsulfonyl)pyridazine-3-carboxamide

Systemtic Name: 6-[(5-bromanyl-2-phenylmethoxy-phenyl)methyl-ethyl-amino]-N-(phenylsulfonyl)pyridazine-3-carboxamide Openeye Name: N-(benzenesulfonyl)-6-[(2-benzyloxy-5-bromo-phenyl)methyl-ethyl-amino]pyridazine-3-carboxamide CAS Name: N-(benzenesulfonyl)-6-[(5-bromo-2-phenylmethoxyphenyl)methyl-ethylamino]-3-pyridazinecarboxamide IUPAC Name: N-(benzenesulfonyl)-6-[(5-bromo-2-phenylmethoxyphenyl)methyl-ethylamino]pyridazine-3-carboxamide Traditional Name: 6-[(2-benzoxy-5-bromo-benzyl)-ethyl-amino]-N-besyl-pyridazine-3-carboxamide Formula: C27H25BrN4O4S MolecularWeight: 581.4808

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=C(C=CC(=C1)Br)OCC2=CC=CC=C2)C3=NN=C(C=C3)C(=O)NS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CCN(CC1=C(C=CC(=C1)Br)OCC2=CC=CC=C2)C3=NN=C(C=C3)C(=O)NS(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C27H25BrN4O4S/c1-2-32(18-21-17-22(28)13-15-25(21)36-19-20-9-5-3-6-10-20)26-16-14-24(29-30-26)27(33)31-37(34,35)23-11-7-4-8-12-23/h3-17H,2,18-19H2,1H3,(H,31,33)