6-[(5-bromanyl-2-cyclohex-2-en-1-yloxy-phenyl)methyl-ethyl-amino]-N-(phenylsulfonyl)pyridazine-3-carboxamide

Systemtic Name: 6-[(5-bromanyl-2-cyclohex-2-en-1-yloxy-phenyl)methyl-ethyl-amino]-N-(phenylsulfonyl)pyridazine-3-carboxamide Openeye Name: N-(benzenesulfonyl)-6-[(5-bromo-2-cyclohex-2-en-1-yloxy-phenyl)methyl-ethyl-amino]pyridazine-3-carboxamide CAS Name: N-(benzenesulfonyl)-6-[[5-bromo-2-(1-cyclohex-2-enyloxy)phenyl]methyl-ethylamino]-3-pyridazinecarboxamide IUPAC Name: N-(benzenesulfonyl)-6-[(5-bromo-2-cyclohex-2-en-1-yloxyphenyl)methyl-ethylamino]pyridazine-3-carboxamide Traditional Name: N-besyl-6-[(5-bromo-2-cyclohex-2-en-1-yloxy-benzyl)-ethyl-amino]pyridazine-3-carboxamide Formula: C26H27BrN4O4S MolecularWeight: 571.48598

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=C(C=CC(=C1)Br)OC2CCCC=C2)C3=NN=C(C=C3)C(=O)NS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CCN(CC1=C(C=CC(=C1)Br)OC2CCCC=C2)C3=NN=C(C=C3)C(=O)NS(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C26H27BrN4O4S/c1-2-31(18-19-17-20(27)13-15-24(19)35-21-9-5-3-6-10-21)25-16-14-23(28-29-25)26(32)30-36(33,34)22-11-7-4-8-12-22/h4-5,7-9,11-17,21H,2-3,6,10,18H2,1H3,(H,30,32)