4-[[(3-bromanyl-4-methoxy-phenyl)sulfonyl-cyclopropyl-amino]methyl]-N-cyclopropyl-benzamide

Systemtic Name: 4-[[(3-bromanyl-4-methoxy-phenyl)sulfonyl-cyclopropyl-amino]methyl]-N-cyclopropyl-benzamide Openeye Name: 4-[[(3-bromo-4-methoxy-phenyl)sulfonyl-cyclopropyl-amino]methyl]-N-cyclopropyl-benzamide CAS Name: 4-[[(3-bromo-4-methoxyphenyl)sulfonyl-cyclopropylamino]methyl]-N-cyclopropylbenzamide IUPAC Name: 4-[[(3-bromo-4-methoxyphenyl)sulfonyl-cyclopropylamino]methyl]-N-cyclopropylbenzamide Traditional Name: 4-[[(3-bromo-4-methoxy-phenyl)sulfonyl-cyclopropyl-amino]methyl]-N-cyclopropyl-benzamide Formula: C21H23BrN2O4S MolecularWeight: 479.38732

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N(CC2=CC=C(C=C2)C(=O)NC3CC3)C4CC4)Br

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N(CC2=CC=C(C=C2)C(=O)NC3CC3)C4CC4)Br

InChI

InChI=1S/C21H23BrN2O4S/c1-28-20-11-10-18(12-19(20)22)29(26,27)24(17-8-9-17)13-14-2-4-15(5-3-14)21(25)23-16-6-7-16/h2-5,10-12,16-17H,6-9,13H2,1H3,(H,23,25)