4-[[(5-bromanyl-2-ethoxy-phenyl)sulfonyl-cyclopropyl-amino]methyl]-N-cyclopropyl-benzamide

Systemtic Name: 4-[[(5-bromanyl-2-ethoxy-phenyl)sulfonyl-cyclopropyl-amino]methyl]-N-cyclopropyl-benzamide Openeye Name: 4-[[(5-bromo-2-ethoxy-phenyl)sulfonyl-cyclopropyl-amino]methyl]-N-cyclopropyl-benzamide CAS Name: 4-[[(5-bromo-2-ethoxyphenyl)sulfonyl-cyclopropylamino]methyl]-N-cyclopropylbenzamide IUPAC Name: 4-[[(5-bromo-2-ethoxyphenyl)sulfonyl-cyclopropylamino]methyl]-N-cyclopropylbenzamide Traditional Name: 4-[[(5-bromo-2-ethoxy-phenyl)sulfonyl-cyclopropyl-amino]methyl]-N-cyclopropyl-benzamide Formula: C22H25BrN2O4S MolecularWeight: 493.4139

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)Br)S(=O)(=O)N(CC2=CC=C(C=C2)C(=O)NC3CC3)C4CC4

Isomeric SMILES

CCOC1=C(C=C(C=C1)Br)S(=O)(=O)N(CC2=CC=C(C=C2)C(=O)NC3CC3)C4CC4

InChI

InChI=1S/C22H25BrN2O4S/c1-2-29-20-12-7-17(23)13-21(20)30(27,28)25(19-10-11-19)14-15-3-5-16(6-4-15)22(26)24-18-8-9-18/h3-7,12-13,18-19H,2,8-11,14H2,1H3,(H,24,26)